2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride

C14H22ClN3O2 — CID 120634591

IUPAC2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)NCC2CCCCC2O)nc1
InChIInChI=1S/C14H21N3O2.ClH/c15-11-5-6-12(16-9-11)7-14(19)17-8-10-3-1-2-4-13(10)18;/h5-6,9-10,13,18H,1-4,7-8,15H2,(H,17,19);1H
InChIKeySHNICSAHANCIEC-UHFFFAOYSA-N
MW299.80 g/mol
LogP1.30
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride (PubChem CID 120634591) has the molecular formula C14H22ClN3O2 and a molecular weight of 299.80 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride
PubChem CID120634591
Molecular FormulaC14H22ClN3O2
Molecular Weight299.80 g/mol
Exact Mass299.14
IUPAC Name2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)NCC2CCCCC2O)nc1
InChIInChI=1S/C14H21N3O2.ClH/c15-11-5-6-12(16-9-11)7-14(19)17-8-10-3-1-2-4-13(10)18;/h5-6,9-10,13,18H,1-4,7-8,15H2,(H,17,19);1H
InChIKeySHNICSAHANCIEC-UHFFFAOYSA-N
XLogP1.30
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 107339076
2-(5-amino-2-pyridinyl)-N-(2-cyclopropylethyl)acetamide;hydrochloride
CID 120633863
2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide
CID 107413069
2-(5-amino-2-pyridinyl)-N-(1,4-dithian-2-ylmethyl)acetamide;hydrochloride
CID 120633463
2-(5-amino-2-pyridinyl)-N-(2-tert-butylcyclohexyl)acetamide;hydrochloride
CID 120621478
2-(5-amino-2-pyridinyl)-N-(2-methylcycloheptyl)acetamide
CID 107339059
2-(5-amino-2-pyridinyl)-N-(2,2-difluoroethyl)acetamide;hydrochloride
CID 120632231
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
CID 107337718
2-(5-amino-2-pyridinyl)-N-[(1-methylcyclopropyl)methyl]acetamide;hydrochloride
CID 120635774
2-(5-amino-2-pyridinyl)-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]acetamide
CID 107339008
1-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 107339432
2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
CID 120633539

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride (CID 120634591) is 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride is Cl.Nc1ccc(CC(=O)NCC2CCCCC2O)nc1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride?
The InChIKey is SHNICSAHANCIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2.ClH/c15-11-5-6-12(16-9-11)7-14(19)17-8-10-3-1-2-4-13(10)18;/h5-6,9-10,13,18H,1-4,7-8,15H2,(H,17,19);1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride has a molecular weight of 299.80 g/mol, XLogP of 1.30, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 120634591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).