(3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide

C14H29N3O — CID 81141730

IUPAC(3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide
SMILESCC(C)CC(CNC(=O)[C@@H]1CCCNC1)N(C)C
InChIInChI=1S/C14H29N3O/c1-11(2)8-13(17(3)4)10-16-14(18)12-6-5-7-15-9-12/h11-13,15H,5-10H2,1-4H3,(H,16,18)/t12-,13?/m1/s1
InChIKeyZKGLREQUEIIXQZ-PZORYLMUSA-N
MW255.41 g/mol
LogP1.08
Rot. Bonds6

About (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide

(3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide (PubChem CID 81141730) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide
PubChem CID81141730
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name(3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide
SMILESCC(C)CC(CNC(=O)[C@@H]1CCCNC1)N(C)C
InChIInChI=1S/C14H29N3O/c1-11(2)8-13(17(3)4)10-16-14(18)12-6-5-7-15-9-12/h11-13,15H,5-10H2,1-4H3,(H,16,18)/t12-,13?/m1/s1
InChIKeyZKGLREQUEIIXQZ-PZORYLMUSA-N
XLogP1.08
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-3-[(piperidine-3-carbonylamino)methyl]hexanoic acid
CID 65492071
N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
CID 119330823
(3S)-N-[2-(dimethylcarbamoylamino)ethyl]piperidine-3-carboxamide
CID 83111640
(3R)-N-(3-methoxy-2-methylpropyl)piperidine-3-carboxamide
CID 81140932
(3S)-N-(2-methylpropyl)pyrrolidine-3-carboxamide;hydrochloride
CID 130617113
N-(4-methylpentyl)piperidine-3-carboxamide
CID 61043776
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
N-(2-cyclopropyl-2-hydroxyethyl)piperidine-3-carboxamide
CID 63297016
2-hydroxy-3-[[(3R)-piperidine-3-carbonyl]amino]propanoic acid
CID 81134818
(3R)-N-[2-(dimethylamino)-2-oxoethyl]piperidine-3-carboxamide
CID 81123203
N-(2,3-dihydroxypropyl)piperidine-3-carboxamide
CID 66169749
methyl 2-hydroxy-3-[[(3S)-piperidine-3-carbonyl]amino]propanoate
CID 107222681

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide (CID 81141730) is (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide is CC(C)CC(CNC(=O)[C@@H]1CCCNC1)N(C)C.
What is the InChIKey of (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide?
The InChIKey is ZKGLREQUEIIXQZ-PZORYLMUSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)8-13(17(3)4)10-16-14(18)12-6-5-7-15-9-12/h11-13,15H,5-10H2,1-4H3,(H,16,18)/t12-,13?/m1/s1.
What are the key properties of (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide?
(3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 1.08, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide is sourced from PubChem (CID 81141730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).