N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide

C15H27N3O2 — CID 103809389

IUPACN-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)[C@H]2CCCCN2)CC1
InChIInChI=1S/C15H27N3O2/c1-2-5-14(19)17-12-7-10-18(11-8-12)15(20)13-6-3-4-9-16-13/h12-13,16H,2-11H2,1H3,(H,17,19)/t13-/m1/s1
InChIKeyYBMJGWZFVPCKDX-CYBMUJFWSA-N
MW281.40 g/mol
LogP1.04
Rot. Bonds4

About N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide

N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide (PubChem CID 103809389) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide.

Molecular Properties

Compound NameN-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide
PubChem CID103809389
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)[C@H]2CCCCN2)CC1
InChIInChI=1S/C15H27N3O2/c1-2-5-14(19)17-12-7-10-18(11-8-12)15(20)13-6-3-4-9-16-13/h12-13,16H,2-11H2,1H3,(H,17,19)/t13-/m1/s1
InChIKeyYBMJGWZFVPCKDX-CYBMUJFWSA-N
XLogP1.04
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-methylpiperidine-2-carbonyl)piperidin-4-yl]butanamide
CID 114423431
N-[1-[(2S)-piperidine-2-carbonyl]piperidin-4-yl]acetamide
CID 103810108
N-[1-[(2S)-piperidine-2-carbonyl]piperidin-4-yl]cyclopropanecarboxamide;hydrochloride
CID 119702485
[(2R)-piperidin-2-yl]-(4-propan-2-ylazepan-1-yl)methanone
CID 113266870
(4-methylpiperidin-1-yl)-piperidin-2-ylmethanone;hydrochloride
CID 2794697
ethyl 4-(azepane-2-carbonyl)piperazine-1-carboxylate
CID 64563459
[(2R)-piperidin-2-yl]-(4-propan-2-ylazepan-1-yl)methanone;hydrochloride
CID 119787837
piperidin-2-yl-(4-propan-2-ylazepan-1-yl)methanone;hydrochloride
CID 119326089
[(2S)-piperidin-2-yl]-(4-propylsulfonylpiperazin-1-yl)methanone
CID 103808772
(4-propylpiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 94372824
azepan-1-yl(azepan-2-yl)methanone
CID 64562203
azepan-1-yl-[(2R)-piperidin-2-yl]methanone
CID 7183049

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide?
The IUPAC name of N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide (CID 103809389) is N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide.
What is the SMILES notation for N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide?
The canonical SMILES for N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide is CCCC(=O)NC1CCN(C(=O)[C@H]2CCCCN2)CC1.
What is the InChIKey of N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide?
The InChIKey is YBMJGWZFVPCKDX-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-2-5-14(19)17-12-7-10-18(11-8-12)15(20)13-6-3-4-9-16-13/h12-13,16H,2-11H2,1H3,(H,17,19)/t13-/m1/s1.
What are the key properties of N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide?
N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide has a molecular weight of 281.40 g/mol, XLogP of 1.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide is sourced from PubChem (CID 103809389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).