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

C14H29N3O — CID 113267374

IUPAC(2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide
SMILESCC(C)CC(CNC(=O)[C@H]1CCCCN1)N(C)C
InChIInChI=1S/C14H29N3O/c1-11(2)9-12(17(3)4)10-16-14(18)13-7-5-6-8-15-13/h11-13,15H,5-10H2,1-4H3,(H,16,18)/t12?,13-/m1/s1
InChIKeyJDBMHYCFCUYZPE-ZGTCLIOFSA-N
MW255.41 g/mol
LogP1.22
Rot. Bonds6

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

(2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide (PubChem CID 113267374) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide
PubChem CID113267374
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name(2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide
SMILESCC(C)CC(CNC(=O)[C@H]1CCCCN1)N(C)C
InChIInChI=1S/C14H29N3O/c1-11(2)9-12(17(3)4)10-16-14(18)13-7-5-6-8-15-13/h11-13,15H,5-10H2,1-4H3,(H,16,18)/t12?,13-/m1/s1
InChIKeyJDBMHYCFCUYZPE-ZGTCLIOFSA-N
XLogP1.22
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 ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide?
The IUPAC name of (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide (CID 113267374) is (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide is CC(C)CC(CNC(=O)[C@H]1CCCCN1)N(C)C.
What is the InChIKey of (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide?
The InChIKey is JDBMHYCFCUYZPE-ZGTCLIOFSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)9-12(17(3)4)10-16-14(18)13-7-5-6-8-15-13/h11-13,15H,5-10H2,1-4H3,(H,16,18)/t12?,13-/m1/s1.
What are the key properties of (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide?
(2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-2-carboxamide is sourced from PubChem (CID 113267374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).