4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide

C14H24N4O — CID 107159414

IUPAC4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC(N)CC(C)C)ccn1
InChIInChI=1S/C14H24N4O/c1-4-16-14(19)13-8-12(5-6-17-13)18-9-11(15)7-10(2)3/h5-6,8,10-11H,4,7,9,15H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyRRTLHKXSBSPOBL-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.62
Rot. Bonds7

About 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide

4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide (PubChem CID 107159414) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide
PubChem CID107159414
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC(N)CC(C)C)ccn1
InChIInChI=1S/C14H24N4O/c1-4-16-14(19)13-8-12(5-6-17-13)18-9-11(15)7-10(2)3/h5-6,8,10-11H,4,7,9,15H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyRRTLHKXSBSPOBL-UHFFFAOYSA-N
XLogP1.62
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide
CID 113234707
4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
CID 43517858
4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
CID 43517863
4-(tert-butylamino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109202921
N-(2-methoxyethyl)-4-(2-methylpropylamino)pyridine-2-carboxamide
CID 109203048
N-ethyl-4-[[(2S,3S)-2-hydroxy-2,3-dimethylpentyl]amino]pyridine-2-carboxamide
CID 97212779
N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 62142219
4-[(4-amino-2,2-dimethylbutyl)amino]-N-ethylpyridine-2-carboxamide
CID 106142444
N-ethyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 55101029
N-(2-amino-4-methylpentyl)pyridine-2-carboxamide
CID 107158631
1-N-(2-methoxy-4-pyridinyl)-4-methylpentane-1,2-diamine
CID 107159402
N-ethyl-4-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-2-carboxamide
CID 79358278

Frequently Asked Questions

What is the IUPAC name of 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide?
The IUPAC name of 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide (CID 107159414) is 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide is CCNC(=O)c1cc(NCC(N)CC(C)C)ccn1.
What is the InChIKey of 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide?
The InChIKey is RRTLHKXSBSPOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-16-14(19)13-8-12(5-6-17-13)18-9-11(15)7-10(2)3/h5-6,8,10-11H,4,7,9,15H2,1-3H3,(H,16,19)(H,17,18).
What are the key properties of 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide?
4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.62, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 107159414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).