5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride

C20H31Cl2N5O2 — CID 22992238

IUPAC5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride
SMILESCCCc1cn2c(N)c(Cl)cc(C(=O)NC3CCN(CCCOC)CC3)c2n1.Cl
InChIInChI=1S/C20H30ClN5O2.ClH/c1-3-5-15-13-26-18(22)17(21)12-16(19(26)23-15)20(27)24-14-6-9-25(10-7-14)8-4-11-28-2;/h12-14H,3-11,22H2,1-2H3,(H,24,27);1H
InChIKeyCSKBWSRZEORDCU-UHFFFAOYSA-N
MW444.41 g/mol
LogP3.17
Rot. Bonds8

About 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride

5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride (PubChem CID 22992238) has the molecular formula C20H31Cl2N5O2 and a molecular weight of 444.41 g/mol. Its IUPAC name is 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride
PubChem CID22992238
Molecular FormulaC20H31Cl2N5O2
Molecular Weight444.41 g/mol
Exact Mass443.19
IUPAC Name5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride
SMILESCCCc1cn2c(N)c(Cl)cc(C(=O)NC3CCN(CCCOC)CC3)c2n1.Cl
InChIInChI=1S/C20H30ClN5O2.ClH/c1-3-5-15-13-26-18(22)17(21)12-16(19(26)23-15)20(27)24-14-6-9-25(10-7-14)8-4-11-28-2;/h12-14H,3-11,22H2,1-2H3,(H,24,27);1H
InChIKeyCSKBWSRZEORDCU-UHFFFAOYSA-N
XLogP3.17
TPSA84.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.41
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-amino-6-chloro-2-ethyl-N-[[1-(3-morpholin-4-yl-3-oxopropyl)piperidin-4-yl]methyl]imidazo[1,2-a]pyridine-8-carboxamide
CID 10096559
4-amino-5-chloro-N-[1-[3-(trideuterio(113C)methoxy)propyl]piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 121225266
4-amino-5-chloro-N-[1-[3-(trideuteriomethoxy)propyl]piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 162656583
5-amino-6-chloro-N-[[1-(3,3-dimethyl-2-oxobutyl)piperidin-4-yl]methyl]-2-ethylimidazo[1,2-a]pyridine-8-carboxamide
CID 22313273
4-azido-5-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 169325707
4-(carbamothioylamino)-5-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 169358238
4-amino-5-chloro-N-[1-[[1-[3-(ethylamino)propyl]piperidin-4-yl]methyl]piperidin-4-yl]-2-methoxybenzamide
CID 139786696
2-methoxyethyl 4-[4-[(4-acetamido-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]butanoate
CID 139814241
4-amino-N-[1-(3-methoxypropyl)piperidin-4-yl]-5-methyl-2,3-dihydro-1-benzofuran-7-carboxamide
CID 123204755
5-chloro-4-(2,4-diamino-1,3,5-triazaspiro[5.5]undeca-1,3-dien-5-yl)-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 169376307
5-chloro-4-(1,3-dioxoisoindol-2-yl)-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 168518175
4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro-2-methoxybenzamide;dihydrochloride
CID 119827622

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride?
The IUPAC name of 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride (CID 22992238) is 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride.
What is the SMILES notation for 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride?
The canonical SMILES for 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride is CCCc1cn2c(N)c(Cl)cc(C(=O)NC3CCN(CCCOC)CC3)c2n1.Cl.
What is the InChIKey of 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride?
The InChIKey is CSKBWSRZEORDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30ClN5O2.ClH/c1-3-5-15-13-26-18(22)17(21)12-16(19(26)23-15)20(27)24-14-6-9-25(10-7-14)8-4-11-28-2;/h12-14H,3-11,22H2,1-2H3,(H,24,27);1H.
What are the key properties of 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride?
5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride has a molecular weight of 444.41 g/mol, XLogP of 3.17, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2-propylimidazo[1,2-a]pyridine-8-carboxamide;hydrochloride is sourced from PubChem (CID 22992238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).