(3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide

C16H24N4O — CID 125021504

IUPAC(3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(c2ccnc(C3CCNCC3)c2)C1
InChIInChI=1S/C16H24N4O/c17-16(21)13-2-1-9-20(11-13)14-5-8-19-15(10-14)12-3-6-18-7-4-12/h5,8,10,12-13,18H,1-4,6-7,9,11H2,(H2,17,21)/t13-/m1/s1
InChIKeyYKEGPWRHZLCWOT-CYBMUJFWSA-N
MW288.39 g/mol
LogP1.25
Rot. Bonds3

About (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide

(3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide (PubChem CID 125021504) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide
PubChem CID125021504
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name(3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(c2ccnc(C3CCNCC3)c2)C1
InChIInChI=1S/C16H24N4O/c17-16(21)13-2-1-9-20(11-13)14-5-8-19-15(10-14)12-3-6-18-7-4-12/h5,8,10,12-13,18H,1-4,6-7,9,11H2,(H2,17,21)/t13-/m1/s1
InChIKeyYKEGPWRHZLCWOT-CYBMUJFWSA-N
XLogP1.25
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-cyclobutylpyridine-4-carbonyl)pyrrolidine-3-carboxamide
CID 166385180
(3R)-1-(2-cyclopropyloxy-4-pyridinyl)pyrrolidine-3-carboxamide
CID 118058182
1-(3,5-dimethylphenyl)piperidine-3-carboxamide
CID 117008258
2-(1-methylpiperidin-4-yl)-4-pyrrolidin-1-ylpyridine
CID 163230195
1-(2-cyclopropyl-4-pyridinyl)pyrrolidin-3-amine
CID 83832269
(3R)-1-[4-[(pyrimidin-2-ylamino)methyl]phenyl]piperidine-3-carboxamide
CID 94173719
1-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidine-3-carboxamide
CID 117008299
1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
CID 172899862
ethyl 1-(2-methyl-4-pyridinyl)piperidine-3-carboxylate
CID 113482815
(3R)-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide
CID 7353330
1-[4-(aminomethyl)phenyl]piperidine-3-carboxamide
CID 43188147
(3S)-1-[4-(cycloheptylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 94467987

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide (CID 125021504) is (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide is NC(=O)[C@@H]1CCCN(c2ccnc(C3CCNCC3)c2)C1.
What is the InChIKey of (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide?
The InChIKey is YKEGPWRHZLCWOT-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H24N4O/c17-16(21)13-2-1-9-20(11-13)14-5-8-19-15(10-14)12-3-6-18-7-4-12/h5,8,10,12-13,18H,1-4,6-7,9,11H2,(H2,17,21)/t13-/m1/s1.
What are the key properties of (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide?
(3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(2-piperidin-4-yl-4-pyridinyl)piperidine-3-carboxamide is sourced from PubChem (CID 125021504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).