4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide

C16H28N4O — CID 43517863

IUPAC4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCCN(C(C)C)C(C)C)ccn1
InChIInChI=1S/C16H28N4O/c1-6-17-16(21)15-11-14(7-8-19-15)18-9-10-20(12(2)3)13(4)5/h7-8,11-13H,6,9-10H2,1-5H3,(H,17,21)(H,18,19)
InChIKeyBQFFTJCVUSWEFO-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.36
Rot. Bonds8

About 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide

4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide (PubChem CID 43517863) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
PubChem CID43517863
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCCN(C(C)C)C(C)C)ccn1
InChIInChI=1S/C16H28N4O/c1-6-17-16(21)15-11-14(7-8-19-15)18-9-10-20(12(2)3)13(4)5/h7-8,11-13H,6,9-10H2,1-5H3,(H,17,21)(H,18,19)
InChIKeyBQFFTJCVUSWEFO-UHFFFAOYSA-N
XLogP2.36
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-[di(propan-2-yl)amino]ethylamino]pyridine-2-carboxylic acid
CID 43143006
4-[2-[cyclopropyl(ethyl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
CID 103739556
N-ethyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 55101029
N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 62142219
4-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-2-carboxamide
CID 109207266
N-[2-(dimethylamino)propyl]-4-(propylamino)pyridine-2-carboxamide
CID 55047383
4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
CID 43517858
N,N-dimethyl-4-[2-[methyl(propan-2-yl)amino]ethylamino]pyridine-2-carboxamide
CID 62642740
4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide
CID 113234707
N-ethyl-4-[[(2S,3S)-2-hydroxy-2,3-dimethylpentyl]amino]pyridine-2-carboxamide
CID 97212779
4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide
CID 107159414
N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide
CID 114516097

Frequently Asked Questions

What is the IUPAC name of 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide?
The IUPAC name of 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide (CID 43517863) is 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide is CCNC(=O)c1cc(NCCN(C(C)C)C(C)C)ccn1.
What is the InChIKey of 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide?
The InChIKey is BQFFTJCVUSWEFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-6-17-16(21)15-11-14(7-8-19-15)18-9-10-20(12(2)3)13(4)5/h7-8,11-13H,6,9-10H2,1-5H3,(H,17,21)(H,18,19).
What are the key properties of 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide?
4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide has a molecular weight of 292.43 g/mol, XLogP of 2.36, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 43517863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).