6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide

C16H26N4O — CID 95591154

IUPAC6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide
SMILESCC(C)N1CC[C@H](CNC(=O)c2ccc(N(C)C)nc2)C1
InChIInChI=1S/C16H26N4O/c1-12(2)20-8-7-13(11-20)9-18-16(21)14-5-6-15(17-10-14)19(3)4/h5-6,10,12-13H,7-9,11H2,1-4H3,(H,18,21)/t13-/m1/s1
InChIKeyKKOXAVCCNCUEMW-CYBMUJFWSA-N
MW290.41 g/mol
LogP1.61
Rot. Bonds5

About 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide

6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide (PubChem CID 95591154) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide
PubChem CID95591154
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide
SMILESCC(C)N1CC[C@H](CNC(=O)c2ccc(N(C)C)nc2)C1
InChIInChI=1S/C16H26N4O/c1-12(2)20-8-7-13(11-20)9-18-16(21)14-5-6-15(17-10-14)19(3)4/h5-6,10,12-13H,7-9,11H2,1-4H3,(H,18,21)/t13-/m1/s1
InChIKeyKKOXAVCCNCUEMW-CYBMUJFWSA-N
XLogP1.61
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(dimethylamino)-N-[[(3R)-1-phenylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide
CID 38441786
6-(dimethylamino)-N-[[(3R)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyridine-3-carboxamide
CID 95591144
6-(dimethylamino)-N-[[(3R)-1,1-dioxothiolan-3-yl]methyl]pyridine-3-carboxamide
CID 94093510
1-tert-butyl-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyrazole-4-carboxamide
CID 94823029
6-(dimethylamino)-N-[(3-hydroxycyclohexyl)methyl]pyridine-3-carboxamide
CID 103690739
4-bromo-3-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzamide
CID 115770297
2-oxo-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-1H-pyridine-4-carboxamide
CID 103764726
4-methyl-2-propan-2-yl-N-[[(3S)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyrimidine-5-carboxamide
CID 95204324
4-amino-6-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-3-carboxamide
CID 81243278
N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide
CID 125137746
6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120828209
5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide
CID 107374811

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide?
The IUPAC name of 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide (CID 95591154) is 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide is CC(C)N1CC[C@H](CNC(=O)c2ccc(N(C)C)nc2)C1.
What is the InChIKey of 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide?
The InChIKey is KKOXAVCCNCUEMW-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12(2)20-8-7-13(11-20)9-18-16(21)14-5-6-15(17-10-14)19(3)4/h5-6,10,12-13H,7-9,11H2,1-4H3,(H,18,21)/t13-/m1/s1.
What are the key properties of 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide?
6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 95591154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).