2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate

C14H28N2O2 — CID 15676966

IUPAC2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate
SMILESCC(C)COC(=O)N(CC(C)C)C1CCNCC1
InChIInChI=1S/C14H28N2O2/c1-11(2)9-16(13-5-7-15-8-6-13)14(17)18-10-12(3)4/h11-13,15H,5-10H2,1-4H3
InChIKeyYSIIBYCDRQSSNI-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.49
Rot. Bonds5

About 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate

2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate (PubChem CID 15676966) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate.

Molecular Properties

Compound Name2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate
PubChem CID15676966
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate
SMILESCC(C)COC(=O)N(CC(C)C)C1CCNCC1
InChIInChI=1S/C14H28N2O2/c1-11(2)9-16(13-5-7-15-8-6-13)14(17)18-10-12(3)4/h11-13,15H,5-10H2,1-4H3
InChIKeyYSIIBYCDRQSSNI-UHFFFAOYSA-N
XLogP2.49
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methylpropyl N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)carbamate
CID 43604144
2-methylpropyl N-ethyl-N-[(3R)-piperidin-3-yl]carbamate
CID 162725358
2-methylpropyl N-cyclopentyl-N-methylcarbamate
CID 163485016
2-methylpropyl N-cyclobutyl-N-(3-hydroxypropyl)carbamate
CID 102867439
2-methylpropyl N-(2-aminoethyl)-N-cyclohexylcarbamate
CID 55242551
2-methylpropyl N-(4-aminocyclohexyl)-N-methylcarbamate
CID 79122045
2-methylpropyl piperidin-4-ylmethyl carbonate
CID 79338526
2-[methyl(piperidin-4-yl)amino]-N,N-bis(2-methylpropyl)acetamide;hydrochloride
CID 119912437
propan-2-yl N-cyclopentyl-N-(2-methylpropyl)carbamate
CID 116656757
N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide
CID 54923747
N-ethyl-3-methyl-N-piperidin-4-ylbutanamide
CID 60806063
2-methylpropyl 3-piperidin-4-yloxypropanoate
CID 63869912

Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate?
The IUPAC name of 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate (CID 15676966) is 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate.
What is the SMILES notation for 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate?
The canonical SMILES for 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate is CC(C)COC(=O)N(CC(C)C)C1CCNCC1.
What is the InChIKey of 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate?
The InChIKey is YSIIBYCDRQSSNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11(2)9-16(13-5-7-15-8-6-13)14(17)18-10-12(3)4/h11-13,15H,5-10H2,1-4H3.
What are the key properties of 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate?
2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate has a molecular weight of 256.39 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl N-(2-methylpropyl)-N-piperidin-4-ylcarbamate is sourced from PubChem (CID 15676966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).