3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride

C18H28ClN5O — CID 120911395

IUPAC3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
SMILESCc1ccn2c(CN3CCCCC3CNC(=O)CCN)cnc2c1.Cl
InChIInChI=1S/C18H27N5O.ClH/c1-14-6-9-23-16(12-20-17(23)10-14)13-22-8-3-2-4-15(22)11-21-18(24)5-7-19;/h6,9-10,12,15H,2-5,7-8,11,13,19H2,1H3,(H,21,24);1H
InChIKeyOJZFVJMBHPEEGJ-UHFFFAOYSA-N
MW365.91 g/mol
LogP1.88
Rot. Bonds6

About 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride

3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride (PubChem CID 120911395) has the molecular formula C18H28ClN5O and a molecular weight of 365.91 g/mol. Its IUPAC name is 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
PubChem CID120911395
Molecular FormulaC18H28ClN5O
Molecular Weight365.91 g/mol
Exact Mass365.20
IUPAC Name3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
SMILESCc1ccn2c(CN3CCCCC3CNC(=O)CCN)cnc2c1.Cl
InChIInChI=1S/C18H27N5O.ClH/c1-14-6-9-23-16(12-20-17(23)10-14)13-22-8-3-2-4-15(22)11-21-18(24)5-7-19;/h6,9-10,12,15H,2-5,7-8,11,13,19H2,1H3,(H,21,24);1H
InChIKeyOJZFVJMBHPEEGJ-UHFFFAOYSA-N
XLogP1.88
TPSA75.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.91
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride with MolForge

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Related Compounds

3-amino-N-[[1-[(3,5-dimethylphenyl)methyl]piperidin-2-yl]methyl]propanamide
CID 120581429
3-amino-N-[[1-[(3-methylimidazol-4-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120911593
3-amino-N-[[1-[[2-(3,5-dimethylphenyl)triazol-4-yl]methyl]piperidin-2-yl]methyl]propanamide
CID 120911408
3-amino-N-[[1-[(2-ethylpyrazol-3-yl)methyl]piperidin-2-yl]methyl]propanamide
CID 120911130
3-amino-N-[[1-[(5-chloro-1,3-thiazol-2-yl)methyl]piperidin-2-yl]methyl]propanamide
CID 120911016
3-amino-N-[[1-[(2-propan-2-ylpyrazol-3-yl)methyl]piperidin-2-yl]methyl]propanamide
CID 120911586
3-amino-N-[[1-[(4-bromo-1-methylpyrazol-5-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120911373
3-amino-N-[[1-[(4-cyclopropyl-1,3-thiazol-5-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120911113
3-amino-N-[[1-[(3-ethoxyphenyl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120911453
3-amino-N-[[1-[(2,5-difluorophenyl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120581300
3-amino-N-[[1-[(3-chloro-2-pyridinyl)methyl]piperidin-2-yl]methyl]propanamide
CID 166247213
3-amino-N-[[1-[(2-bromophenyl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120581348

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride?
The IUPAC name of 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride (CID 120911395) is 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride?
The canonical SMILES for 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride is Cc1ccn2c(CN3CCCCC3CNC(=O)CCN)cnc2c1.Cl.
What is the InChIKey of 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride?
The InChIKey is OJZFVJMBHPEEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O.ClH/c1-14-6-9-23-16(12-20-17(23)10-14)13-22-8-3-2-4-15(22)11-21-18(24)5-7-19;/h6,9-10,12,15H,2-5,7-8,11,13,19H2,1H3,(H,21,24);1H.
What are the key properties of 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride?
3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride has a molecular weight of 365.91 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride is sourced from PubChem (CID 120911395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).