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

C16H26N4O — CID 62238644

IUPAC6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide
SMILESCCNc1cccc(C(=O)NCC2CCN(C(C)C)C2)n1
InChIInChI=1S/C16H26N4O/c1-4-17-15-7-5-6-14(19-15)16(21)18-10-13-8-9-20(11-13)12(2)3/h5-7,12-13H,4,8-11H2,1-3H3,(H,17,19)(H,18,21)
InChIKeyVCXDJGXBHTXGGD-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.97
Rot. Bonds6

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

6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide (PubChem CID 62238644) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide
PubChem CID62238644
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide
SMILESCCNc1cccc(C(=O)NCC2CCN(C(C)C)C2)n1
InChIInChI=1S/C16H26N4O/c1-4-17-15-7-5-6-14(19-15)16(21)18-10-13-8-9-20(11-13)12(2)3/h5-7,12-13H,4,8-11H2,1-3H3,(H,17,19)(H,18,21)
InChIKeyVCXDJGXBHTXGGD-UHFFFAOYSA-N
XLogP1.97
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dihydroxy-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzamide
CID 114344239
6-chloro-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridazine-3-carboxamide
CID 61216005
6-(ethylamino)-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide
CID 62239679
5-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrazine-2-carboxamide
CID 107374811
2-hydroxy-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzamide
CID 51094816
6-chloro-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 95388376
2-fluoro-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzamide
CID 51090077
6-[(1-ethylpyrrolidin-3-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 60855368
2-[(1-propan-2-ylpyrrolidin-3-yl)methylcarbamoyl]pyridine-3-carboxylic acid
CID 63616085
2-amino-3-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzamide
CID 61207718
3-(2-aminoethyl)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzamide
CID 62593153
N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-1H-indazole-3-carboxamide
CID 60598271

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide (CID 62238644) is 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide is CCNc1cccc(C(=O)NCC2CCN(C(C)C)C2)n1.
What is the InChIKey of 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide?
The InChIKey is VCXDJGXBHTXGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-4-17-15-7-5-6-14(19-15)16(21)18-10-13-8-9-20(11-13)12(2)3/h5-7,12-13H,4,8-11H2,1-3H3,(H,17,19)(H,18,21).
What are the key properties of 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide?
6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 1.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 62238644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).