N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine

C20H24N4 — CID 22933598

IUPACN-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine
SMILESCn1ncc2cc(NC3CCN(Cc4ccccc4)CC3)ccc21
InChIInChI=1S/C20H24N4/c1-23-20-8-7-19(13-17(20)14-21-23)22-18-9-11-24(12-10-18)15-16-5-3-2-4-6-16/h2-8,13-14,18,22H,9-12,15H2,1H3
InChIKeyRQRLQKZRMRXUBZ-UHFFFAOYSA-N
MW320.44 g/mol
LogP3.65
Rot. Bonds4

About N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine

N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine (PubChem CID 22933598) has the molecular formula C20H24N4 and a molecular weight of 320.44 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine
PubChem CID22933598
Molecular FormulaC20H24N4
Molecular Weight320.44 g/mol
Exact Mass320.20
IUPAC NameN-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine
SMILESCn1ncc2cc(NC3CCN(Cc4ccccc4)CC3)ccc21
InChIInChI=1S/C20H24N4/c1-23-20-8-7-19(13-17(20)14-21-23)22-18-9-11-24(12-10-18)15-16-5-3-2-4-6-16/h2-8,13-14,18,22H,9-12,15H2,1H3
InChIKeyRQRLQKZRMRXUBZ-UHFFFAOYSA-N
XLogP3.65
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-(4-methylcyclohexyl)indazol-5-amine
CID 59514269
1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine
CID 43540095
1-N-(1-benzylpiperidin-4-yl)-4-N,4-N-dimethylbenzene-1,4-diamine
CID 90316616
3-[(1-benzylpiperidin-4-yl)amino]phenol
CID 28722324
4-N-(1-benzylpiperidin-4-yl)-6-methyl-2-N-(2-methylpyrazol-3-yl)pyrimidine-2,4-diamine
CID 117081921
N-(1-benzylpiperidin-4-yl)-5-bromopyridin-3-amine
CID 115656855
2-N,4-N-bis(1-benzylpiperidin-4-yl)-6-methylpyrimidine-2,4-diamine
CID 117084915
1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidin-4-amine
CID 118997215
4-N-(1-benzylpiperidin-4-yl)-2-methoxybenzene-1,4-diamine
CID 58608359
tert-butyl 5-[(1-benzylpiperidin-3-yl)amino]indazole-1-carboxylate
CID 70979242
4-N-(1-benzylpiperidin-4-yl)-6-N-(2-methylpyrazol-3-yl)pyrimidine-4,6-diamine
CID 117086261
N-(1-benzylpyrrolidin-3-yl)-1-ethylpyrazol-4-amine
CID 43543283

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine (CID 22933598) is N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine is Cn1ncc2cc(NC3CCN(Cc4ccccc4)CC3)ccc21.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine?
The InChIKey is RQRLQKZRMRXUBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4/c1-23-20-8-7-19(13-17(20)14-21-23)22-18-9-11-24(12-10-18)15-16-5-3-2-4-6-16/h2-8,13-14,18,22H,9-12,15H2,1H3.
What are the key properties of N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine?
N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine has a molecular weight of 320.44 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-1-methylindazol-5-amine is sourced from PubChem (CID 22933598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).