4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide

C14H22N4O2 — CID 60926875

IUPAC4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide
SMILESCCN(CC)C(=O)CCNc1ccnc(C(=O)NC)c1
InChIInChI=1S/C14H22N4O2/c1-4-18(5-2)13(19)7-9-16-11-6-8-17-12(10-11)14(20)15-3/h6,8,10H,4-5,7,9H2,1-3H3,(H,15,20)(H,16,17)
InChIKeyBNLYHIIPEZKBRL-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.11
Rot. Bonds7

About 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide

4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide (PubChem CID 60926875) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide
PubChem CID60926875
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide
SMILESCCN(CC)C(=O)CCNc1ccnc(C(=O)NC)c1
InChIInChI=1S/C14H22N4O2/c1-4-18(5-2)13(19)7-9-16-11-6-8-17-12(10-11)14(20)15-3/h6,8,10H,4-5,7,9H2,1-3H3,(H,15,20)(H,16,17)
InChIKeyBNLYHIIPEZKBRL-UHFFFAOYSA-N
XLogP1.11
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-ethoxyethylamino)-N-methylpyridine-2-carboxamide
CID 43591225
N-methyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 62665007
N,N-diethyl-4-(propylamino)pyridine-2-carboxamide
CID 43395263
4-[[2-(diethylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid
CID 113406283
6-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridazine-3-carboxamide
CID 79207468
4-[(2-amino-2-ethylbutyl)amino]-N-methylpyridine-2-carboxamide
CID 113283242
4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 64695920
4-[3-(cyclopropylamino)propylamino]-N-methylpyridine-2-carboxamide
CID 43599645
N-methyl-4-[2-(2-methylphenyl)ethylamino]pyridine-2-carboxamide
CID 112722856
2-methyl-2-[[2-(methylcarbamoyl)-4-pyridinyl]amino]propanoic acid
CID 61264748
N-methyl-4-[2-(4-methylpiperidin-1-yl)ethylamino]pyridine-2-carboxamide
CID 61241269
4-(2,2-dimethylhydrazinyl)-N-methylpyridine-2-carboxamide
CID 83025450

Frequently Asked Questions

What is the IUPAC name of 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide (CID 60926875) is 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide is CCN(CC)C(=O)CCNc1ccnc(C(=O)NC)c1.
What is the InChIKey of 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide?
The InChIKey is BNLYHIIPEZKBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-4-18(5-2)13(19)7-9-16-11-6-8-17-12(10-11)14(20)15-3/h6,8,10H,4-5,7,9H2,1-3H3,(H,15,20)(H,16,17).
What are the key properties of 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide?
4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 1.11, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 60926875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).