N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride

C16H26Cl2N4O2 — CID 119602673

IUPACN-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride
SMILESCl.Cl.NCC1CCCC1NC(=O)c1cccnc1N1CCOCC1
InChIInChI=1S/C16H24N4O2.2ClH/c17-11-12-3-1-5-14(12)19-16(21)13-4-2-6-18-15(13)20-7-9-22-10-8-20;;/h2,4,6,12,14H,1,3,5,7-11,17H2,(H,19,21);2*1H
InChIKeyUNVRZIQWCVWZSL-UHFFFAOYSA-N
MW377.32 g/mol
LogP1.62
Rot. Bonds4

About N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride

N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride (PubChem CID 119602673) has the molecular formula C16H26Cl2N4O2 and a molecular weight of 377.32 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride
PubChem CID119602673
Molecular FormulaC16H26Cl2N4O2
Molecular Weight377.32 g/mol
Exact Mass376.14
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride
SMILESCl.Cl.NCC1CCCC1NC(=O)c1cccnc1N1CCOCC1
InChIInChI=1S/C16H24N4O2.2ClH/c17-11-12-3-1-5-14(12)19-16(21)13-4-2-6-18-15(13)20-7-9-22-10-8-20;;/h2,4,6,12,14H,1,3,5,7-11,17H2,(H,19,21);2*1H
InChIKeyUNVRZIQWCVWZSL-UHFFFAOYSA-N
XLogP1.62
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.32
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-2-morpholin-4-ylpyridine-3-carboxamide
CID 51925941
N-(3-methylpiperidin-4-yl)-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride
CID 120554046
N-(2-aminoethyl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 119383590
N-[2-(aminomethyl)cyclopentyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide
CID 62955505
N-[2-(aminomethyl)cyclopentyl]-2-benzoylbenzamide;hydrochloride
CID 119600470
N-[2-(aminomethyl)cyclopentyl]-1-(3-chloro-2-pyridinyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 119602270
N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride
CID 119609179
N-(2-methylpiperidin-3-yl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride
CID 120577474
3-[(2-morpholin-4-ylpyridine-3-carbonyl)amino]propanoic acid
CID 119350991
2-morpholin-4-yl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
CID 119461977
N-[4-chloro-3-(cyclohexylcarbamoyl)phenyl]-2-morpholin-4-ylpyridine-3-carboxamide
CID 55906780
N-[2-(aminomethyl)cyclopentyl]-2-(2-amino-2-oxoethoxy)benzamide
CID 119604933

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride (CID 119602673) is N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride is Cl.Cl.NCC1CCCC1NC(=O)c1cccnc1N1CCOCC1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride?
The InChIKey is UNVRZIQWCVWZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2.2ClH/c17-11-12-3-1-5-14(12)19-16(21)13-4-2-6-18-15(13)20-7-9-22-10-8-20;;/h2,4,6,12,14H,1,3,5,7-11,17H2,(H,19,21);2*1H.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride?
N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride has a molecular weight of 377.32 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119602673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).