benzyl N-(cyclopropylmethyl)carbamate

C12H15NO2 — CID 53419264

IUPACbenzyl N-(cyclopropylmethyl)carbamate
SMILESO=C(NCC1CC1)OCc1ccccc1
InChIInChI=1S/C12H15NO2/c14-12(13-8-10-6-7-10)15-9-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,13,14)
InChIKeyMZFFDNPTGVONAW-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.32
Rot. Bonds4

About benzyl N-(cyclopropylmethyl)carbamate

benzyl N-(cyclopropylmethyl)carbamate (PubChem CID 53419264) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is benzyl N-(cyclopropylmethyl)carbamate.

Molecular Properties

Compound Namebenzyl N-(cyclopropylmethyl)carbamate
PubChem CID53419264
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Namebenzyl N-(cyclopropylmethyl)carbamate
SMILESO=C(NCC1CC1)OCc1ccccc1
InChIInChI=1S/C12H15NO2/c14-12(13-8-10-6-7-10)15-9-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,13,14)
InChIKeyMZFFDNPTGVONAW-UHFFFAOYSA-N
XLogP2.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze benzyl N-(cyclopropylmethyl)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

benzyl N-[(4-aminocyclohexyl)methyl]carbamate
CID 59845659
benzyl N-[[(1R,3S)-3-hydroxycyclopentyl]methyl]carbamate
CID 124634239
benzyl N-(spiro[2.5]octan-6-ylmethyl)carbamate
CID 71243330
benzyl N-(oxetan-3-ylmethyl)carbamate
CID 155920910
benzyl N-[[4-(phenylcarbamoyl)cyclohexyl]methyl]carbamate
CID 69455097
benzyl N-[(3-methylcyclohexyl)methyl]carbamate
CID 130157820
benzyl N-(azepan-4-ylmethyl)carbamate;hydrochloride
CID 118798557
benzyl N-(thian-3-ylmethyl)carbamate
CID 130813410
benzyl N-[(2-oxopiperidin-4-yl)methyl]carbamate
CID 166139678
benzyl N-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)methyl]carbamate
CID 171936884
2-[3-(phenylmethoxycarbonylaminomethyl)pyrrolidin-1-yl]acetic acid
CID 66566865
3-(phenylmethoxycarbonylaminomethyl)piperidine-1-carboxylic acid
CID 22350247

Frequently Asked Questions

What is the IUPAC name of benzyl N-(cyclopropylmethyl)carbamate?
The IUPAC name of benzyl N-(cyclopropylmethyl)carbamate (CID 53419264) is benzyl N-(cyclopropylmethyl)carbamate.
What is the SMILES notation for benzyl N-(cyclopropylmethyl)carbamate?
The canonical SMILES for benzyl N-(cyclopropylmethyl)carbamate is O=C(NCC1CC1)OCc1ccccc1.
What is the InChIKey of benzyl N-(cyclopropylmethyl)carbamate?
The InChIKey is MZFFDNPTGVONAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c14-12(13-8-10-6-7-10)15-9-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,13,14).
What are the key properties of benzyl N-(cyclopropylmethyl)carbamate?
benzyl N-(cyclopropylmethyl)carbamate has a molecular weight of 205.26 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-(cyclopropylmethyl)carbamate is sourced from PubChem (CID 53419264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).