(3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide

C20H24N4O — CID 98891264

IUPAC(3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(c2ccc(N[C@@H]3CCc4ccccc43)cn2)C1
InChIInChI=1S/C20H24N4O/c21-20(25)15-5-3-11-24(13-15)19-10-8-16(12-22-19)23-18-9-7-14-4-1-2-6-17(14)18/h1-2,4,6,8,10,12,15,18,23H,3,5,7,9,11,13H2,(H2,21,25)/t15-,18-/m1/s1
InChIKeyUKUPEVQSNHWWQL-CRAIPNDOSA-N
MW336.44 g/mol
LogP2.88
Rot. Bonds4

About (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide

(3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide (PubChem CID 98891264) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide
PubChem CID98891264
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name(3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(c2ccc(N[C@@H]3CCc4ccccc43)cn2)C1
InChIInChI=1S/C20H24N4O/c21-20(25)15-5-3-11-24(13-15)19-10-8-16(12-22-19)23-18-9-7-14-4-1-2-6-17(14)18/h1-2,4,6,8,10,12,15,18,23H,3,5,7,9,11,13H2,(H2,21,25)/t15-,18-/m1/s1
InChIKeyUKUPEVQSNHWWQL-CRAIPNDOSA-N
XLogP2.88
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide with MolForge

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Related Compounds

1-[5-[(2-bromobenzoyl)amino]-2-pyridinyl]piperidine-3-carboxamide
CID 55967635
(3S)-1-(5-amino-2-pyridinyl)piperidine-3-carboxamide
CID 30115330
1-(5-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 90309940
(3S)-1-[5-(3-cyclopentylpropanoylamino)-2-pyridinyl]piperidine-3-carboxamide
CID 95312803
N-[6-(3-carbamoylpiperidin-1-yl)-3-pyridinyl]-2-phenyl-1,3-thiazole-5-carboxamide
CID 55970593
1-[5-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoylamino]-2-pyridinyl]piperidine-3-carboxamide
CID 55700912
1-[5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]-2-pyridinyl]piperidine-3-carboxamide
CID 55700725
1-[5-(4-naphthalen-1-yloxybutanoylamino)-2-pyridinyl]piperidine-3-carboxamide
CID 55970974
1-[5-[(4-propan-2-ylphenyl)sulfonylamino]-2-pyridinyl]piperidine-3-carboxamide
CID 86967490
1-[5-[(3-cyanobenzoyl)amino]-2-pyridinyl]piperidine-3-carboxamide
CID 86988880
1-[5-[3-(furan-2-yl)prop-2-enylamino]-2-pyridinyl]piperidine-3-carboxamide
CID 127265138
(3R)-1-(5-nitro-2-pyridinyl)piperidine-3-carboxamide
CID 30994170

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide (CID 98891264) is (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide is NC(=O)[C@@H]1CCCN(c2ccc(N[C@@H]3CCc4ccccc43)cn2)C1.
What is the InChIKey of (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide?
The InChIKey is UKUPEVQSNHWWQL-CRAIPNDOSA-N. The full InChI is InChI=1S/C20H24N4O/c21-20(25)15-5-3-11-24(13-15)19-10-8-16(12-22-19)23-18-9-7-14-4-1-2-6-17(14)18/h1-2,4,6,8,10,12,15,18,23H,3,5,7,9,11,13H2,(H2,21,25)/t15-,18-/m1/s1.
What are the key properties of (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide?
(3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[5-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2-pyridinyl]piperidine-3-carboxamide is sourced from PubChem (CID 98891264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).