1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride

C15H25Cl2N3O — CID 154912060

IUPAC1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride
SMILESCCC(c1cccnc1)N(C)C(=O)C1(N)CCCC1.Cl.Cl
InChIInChI=1S/C15H23N3O.2ClH/c1-3-13(12-7-6-10-17-11-12)18(2)14(19)15(16)8-4-5-9-15;;/h6-7,10-11,13H,3-5,8-9,16H2,1-2H3;2*1H
InChIKeyDYFWBKZDCIQQAF-UHFFFAOYSA-N
MW334.29 g/mol
LogP3.11
Rot. Bonds4

About 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride

1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride (PubChem CID 154912060) has the molecular formula C15H25Cl2N3O and a molecular weight of 334.29 g/mol. Its IUPAC name is 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride.

Molecular Properties

Compound Name1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride
PubChem CID154912060
Molecular FormulaC15H25Cl2N3O
Molecular Weight334.29 g/mol
Exact Mass333.14
IUPAC Name1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride
SMILESCCC(c1cccnc1)N(C)C(=O)C1(N)CCCC1.Cl.Cl
InChIInChI=1S/C15H23N3O.2ClH/c1-3-13(12-7-6-10-17-11-12)18(2)14(19)15(16)8-4-5-9-15;;/h6-7,10-11,13H,3-5,8-9,16H2,1-2H3;2*1H
InChIKeyDYFWBKZDCIQQAF-UHFFFAOYSA-N
XLogP3.11
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.29
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[(1R)-1-pyridin-3-ylpropyl]acetamide
CID 126454196
N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide
CID 74248524
(1-aminocyclohexyl)-[4-(1-pyridin-3-ylethyl)piperazin-1-yl]methanone;trihydrochloride
CID 119903354
3-(dimethylamino)-3-pyridin-3-ylpropanoic acid
CID 64526600
N-methyl-1-oxo-N-(1-pyridin-3-ylpropyl)-2H-isoquinoline-4-carboxamide
CID 74230073
2-(dimethylamino)-2-pyridin-3-ylacetamide;dihydrochloride
CID 67492420
3-[2-(1H-imidazol-5-yl)ethyl]-1-methyl-1-[(1R)-1-pyridin-3-ylpropyl]urea
CID 126434780
1-amino-N-methyl-N-(1-pyridin-4-ylethyl)cyclopropane-1-carboxamide
CID 65463841
ethyl 3-pyridin-3-ylbutanoate
CID 12727116
2-(1-aminocyclohexyl)-N-[(1S)-1-pyridin-3-ylethyl]acetamide
CID 81404106
N-methyl-6-oxo-2-(phenoxymethyl)-N-[(1R)-1-pyridin-3-ylpropyl]-1H-pyrimidine-5-carboxamide
CID 97115377
2-(dimethylamino)-2-pyridin-3-ylethanol
CID 54775729

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride?
The IUPAC name of 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride (CID 154912060) is 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride.
What is the SMILES notation for 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride?
The canonical SMILES for 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride is CCC(c1cccnc1)N(C)C(=O)C1(N)CCCC1.Cl.Cl.
What is the InChIKey of 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride?
The InChIKey is DYFWBKZDCIQQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O.2ClH/c1-3-13(12-7-6-10-17-11-12)18(2)14(19)15(16)8-4-5-9-15;;/h6-7,10-11,13H,3-5,8-9,16H2,1-2H3;2*1H.
What are the key properties of 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride?
1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride has a molecular weight of 334.29 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride is sourced from PubChem (CID 154912060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).