2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate

C15H23NO3 — CID 155404047

IUPAC2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate
SMILESCCC(C)C(C)COC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C15H23NO3/c1-5-11(2)12(3)10-19-15(17)16-13-6-8-14(18-4)9-7-13/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)
InChIKeySVIDDIJUKDKFID-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.93
Rot. Bonds6

About 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate

2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate (PubChem CID 155404047) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate.

Molecular Properties

Compound Name2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate
PubChem CID155404047
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate
SMILESCCC(C)C(C)COC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C15H23NO3/c1-5-11(2)12(3)10-19-15(17)16-13-6-8-14(18-4)9-7-13/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)
InChIKeySVIDDIJUKDKFID-UHFFFAOYSA-N
XLogP3.93
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate 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

[2,3-dihydroxy-4-[(4-methoxyphenyl)carbamoyloxy]butyl] N-(4-methoxyphenyl)carbamate
CID 122366886
methyl (2S,3R)-2-[(4-methoxyphenyl)carbamoylamino]-3-methylpentanoate
CID 944653
2,2,3-trimethylbutyl N-(4-methoxyphenyl)carbamate
CID 59019482
[(2R)-2,3-dimethylbutyl] N-(4-methylphenyl)carbamate;molecular hydrogen
CID 155739096
2-chloroethyl N-(4-methoxyphenyl)carbamate
CID 4190237
hexadecyl N-(4-methoxyphenyl)carbamate
CID 46229876
[2-(4-methoxyanilino)-2-oxoethyl] 2-methylbutanoate
CID 46512060
(2R)-2-hydroxy-N-(4-methoxyphenyl)butanamide
CID 139626636
2-methylpropyl N-[4-[4-(2-methylpropoxycarbonylamino)phenyl]phenyl]carbamate
CID 18877627
ethyl N-(4-propan-2-yloxyphenyl)carbamate
CID 731078
ethyl N-[4-[(2S)-butan-2-yl]phenyl]carbamate
CID 40507045
2-methylpropyl N-(3,5-dimethoxyphenyl)carbamate
CID 134090517

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate?
The IUPAC name of 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate (CID 155404047) is 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate.
What is the SMILES notation for 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate?
The canonical SMILES for 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate is CCC(C)C(C)COC(=O)Nc1ccc(OC)cc1.
What is the InChIKey of 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate?
The InChIKey is SVIDDIJUKDKFID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-5-11(2)12(3)10-19-15(17)16-13-6-8-14(18-4)9-7-13/h6-9,11-12H,5,10H2,1-4H3,(H,16,17).
What are the key properties of 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate?
2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate has a molecular weight of 265.35 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylpentyl N-(4-methoxyphenyl)carbamate is sourced from PubChem (CID 155404047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).