2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide

C11H18N4O — CID 62161100

IUPAC2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccnc(N)c1)N(C)C
InChIInChI=1S/C11H18N4O/c1-8(15(2)3)7-14-11(16)9-4-5-13-10(12)6-9/h4-6,8H,7H2,1-3H3,(H2,12,13)(H,14,16)
InChIKeyOUXBFLOLHBRAEN-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.34
Rot. Bonds4

About 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide

2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide (PubChem CID 62161100) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide
PubChem CID62161100
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccnc(N)c1)N(C)C
InChIInChI=1S/C11H18N4O/c1-8(15(2)3)7-14-11(16)9-4-5-13-10(12)6-9/h4-6,8H,7H2,1-3H3,(H2,12,13)(H,14,16)
InChIKeyOUXBFLOLHBRAEN-UHFFFAOYSA-N
XLogP0.34
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(diethylamino)ethyl]pyridine-4-carboxamide
CID 62156406
2-amino-N-(3-methylpentan-2-yl)pyridine-4-carboxamide
CID 62160554
2-amino-N-[2-(dimethylsulfamoyl)ethyl]pyridine-4-carboxamide
CID 106342687
2-amino-N-[1-(dimethylamino)-3-methylbutan-2-yl]pyridine-4-carboxamide
CID 55041620
2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]pyridine-4-carboxamide
CID 62151627
2-amino-N-hexan-2-ylpyridine-4-carboxamide
CID 62201408
2-amino-N-(4-propan-2-yloxybutyl)pyridine-4-carboxamide
CID 106015103
2-amino-N-propan-2-yl-N-propylpyridine-4-carboxamide
CID 62156310
3-amino-N-[(2S)-2-(dimethylamino)propyl]-5-(trifluoromethyl)benzamide
CID 163362848
2-amino-N-benzylpyridine-4-carboxamide
CID 18752897
3-amino-4,5-dichloro-N-[2-(dimethylamino)propyl]benzamide
CID 61140669
3-(chloromethyl)-N-[2-(dimethylamino)propyl]benzamide
CID 54912956

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide (CID 62161100) is 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide is CC(CNC(=O)c1ccnc(N)c1)N(C)C.
What is the InChIKey of 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide?
The InChIKey is OUXBFLOLHBRAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8(15(2)3)7-14-11(16)9-4-5-13-10(12)6-9/h4-6,8H,7H2,1-3H3,(H2,12,13)(H,14,16).
What are the key properties of 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide?
2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(dimethylamino)propyl]pyridine-4-carboxamide is sourced from PubChem (CID 62161100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).