propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate

C14H25NO2 — CID 112738754

IUPACpropyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate
SMILESCCCOC(=O)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C14H25NO2/c1-2-10-17-14(16)15(13-8-9-13)11-12-6-4-3-5-7-12/h12-13H,2-11H2,1H3
InChIKeyYRNRWXGOYAEZOB-UHFFFAOYSA-N
MW239.36 g/mol
LogP3.58
Rot. Bonds5

About propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate

propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate (PubChem CID 112738754) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate.

Molecular Properties

Compound Namepropyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate
PubChem CID112738754
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Namepropyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate
SMILESCCCOC(=O)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C14H25NO2/c1-2-10-17-14(16)15(13-8-9-13)11-12-6-4-3-5-7-12/h12-13H,2-11H2,1H3
InChIKeyYRNRWXGOYAEZOB-UHFFFAOYSA-N
XLogP3.58
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl N-cyclopropyl-N-(cyclopropylmethyl)carbamate
CID 63101705
2,2,2-trifluoroethyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate
CID 61066671
N-(cyclobutylmethyl)-N-cyclohexylacetamide
CID 91799072
2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide
CID 54873047
(2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide
CID 61174275
2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide
CID 61264857
propyl N-(2-aminocyclohexyl)-N-ethylcarbamate
CID 175258592
propyl 3-cyclopentylpropanoate
CID 43389546
N-(cyclohexylmethyl)-N-cyclopropyl-3-oxobutanamide
CID 54876535
2-(aminomethyl)-N-(cyclohexylmethyl)-N-cyclopropyl-2-ethylbutanamide
CID 115432159
2-hydroxyethyl N-cyclopropyl-N-propylcarbamate
CID 79346146
propan-2-yl N-(cyclohexylmethyl)-N-piperidin-4-ylcarbamate
CID 163411592

Frequently Asked Questions

What is the IUPAC name of propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate?
The IUPAC name of propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate (CID 112738754) is propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate.
What is the SMILES notation for propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate?
The canonical SMILES for propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate is CCCOC(=O)N(CC1CCCCC1)C1CC1.
What is the InChIKey of propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate?
The InChIKey is YRNRWXGOYAEZOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-10-17-14(16)15(13-8-9-13)11-12-6-4-3-5-7-12/h12-13H,2-11H2,1H3.
What are the key properties of propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate?
propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate has a molecular weight of 239.36 g/mol, XLogP of 3.58, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate is sourced from PubChem (CID 112738754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).