1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride

C12H14Cl2N4O — CID 119888960

IUPAC1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride
SMILESCl.Cl.NC1(C(=O)Nc2ccnc3ccncc23)CC1
InChIInChI=1S/C12H12N4O.2ClH/c13-12(3-4-12)11(17)16-10-2-6-15-9-1-5-14-7-8(9)10;;/h1-2,5-7H,3-4,13H2,(H,15,16,17);2*1H
InChIKeyLADLHNILCIFWBA-UHFFFAOYSA-N
MW301.18 g/mol
LogP1.90
Rot. Bonds2

About 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride

1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride (PubChem CID 119888960) has the molecular formula C12H14Cl2N4O and a molecular weight of 301.18 g/mol. Its IUPAC name is 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride.

Molecular Properties

Compound Name1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride
PubChem CID119888960
Molecular FormulaC12H14Cl2N4O
Molecular Weight301.18 g/mol
Exact Mass300.05
IUPAC Name1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride
SMILESCl.Cl.NC1(C(=O)Nc2ccnc3ccncc23)CC1
InChIInChI=1S/C12H12N4O.2ClH/c13-12(3-4-12)11(17)16-10-2-6-15-9-1-5-14-7-8(9)10;;/h1-2,5-7H,3-4,13H2,(H,15,16,17);2*1H
InChIKeyLADLHNILCIFWBA-UHFFFAOYSA-N
XLogP1.90
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.18
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-(4-methyl-3-pyridinyl)cyclopentane-1-carboxamide;dihydrochloride
CID 119858196
N-(1,6-naphthyridin-4-yl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;dihydrochloride
CID 119888990
3-amino-N-(3-fluoro-4-pyridinyl)oxolane-3-carboxamide
CID 107594990
3-amino-N-isoquinolin-5-yloxolane-3-carboxamide
CID 64892312
1-amino-N-pyridin-4-ylcyclohexane-1-carboxamide;dihydrochloride
CID 119827128
1-amino-N-[2-(dimethylamino)-3-pyridinyl]cyclopropane-1-carboxamide
CID 65463803
5-methyl-N-(1,6-naphthyridin-4-yl)-1-piperidin-4-yltriazole-4-carboxamide;dihydrochloride
CID 119888966
(3R)-3-acetyl-N-(1,6-naphthyridin-4-yl)-2-phenyl-3,4-dihydropyrazole-5-carboxamide
CID 95973922
1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide
CID 65466775
1-amino-N-(8-fluoro-6-methoxyquinolin-4-yl)cyclohexane-1-carboxamide
CID 91502629
1-amino-N-(2-ethoxy-3-pyridinyl)cyclopropane-1-carboxamide
CID 65467015
1-amino-N-phenylcyclopropane-1-carboxamide;hydrochloride
CID 75467843

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride?
The IUPAC name of 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride (CID 119888960) is 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride.
What is the SMILES notation for 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride?
The canonical SMILES for 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride is Cl.Cl.NC1(C(=O)Nc2ccnc3ccncc23)CC1.
What is the InChIKey of 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride?
The InChIKey is LADLHNILCIFWBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O.2ClH/c13-12(3-4-12)11(17)16-10-2-6-15-9-1-5-14-7-8(9)10;;/h1-2,5-7H,3-4,13H2,(H,15,16,17);2*1H.
What are the key properties of 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride?
1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride has a molecular weight of 301.18 g/mol, XLogP of 1.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(1,6-naphthyridin-4-yl)cyclopropane-1-carboxamide;dihydrochloride is sourced from PubChem (CID 119888960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).