methyl N-[(3-hydroxycyclopentyl)methyl]carbamate

C8H15NO3 — CID 103279767

IUPACmethyl N-[(3-hydroxycyclopentyl)methyl]carbamate
SMILESCOC(=O)NCC1CCC(O)C1
InChIInChI=1S/C8H15NO3/c1-12-8(11)9-5-6-2-3-7(10)4-6/h6-7,10H,2-5H2,1H3,(H,9,11)
InChIKeyPJLMFJOTPOKNRZ-UHFFFAOYSA-N
MW173.21 g/mol
LogP0.50
Rot. Bonds2

About methyl N-[(3-hydroxycyclopentyl)methyl]carbamate

methyl N-[(3-hydroxycyclopentyl)methyl]carbamate (PubChem CID 103279767) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is methyl N-[(3-hydroxycyclopentyl)methyl]carbamate.

Molecular Properties

Compound Namemethyl N-[(3-hydroxycyclopentyl)methyl]carbamate
PubChem CID103279767
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC Namemethyl N-[(3-hydroxycyclopentyl)methyl]carbamate
SMILESCOC(=O)NCC1CCC(O)C1
InChIInChI=1S/C8H15NO3/c1-12-8(11)9-5-6-2-3-7(10)4-6/h6-7,10H,2-5H2,1H3,(H,9,11)
InChIKeyPJLMFJOTPOKNRZ-UHFFFAOYSA-N
XLogP0.50
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-hydroxycyclopentyl)methyl]-2-methoxypropanamide
CID 103279856
N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide
CID 103280773
2-cyclopropyl-N-[(3-hydroxycyclopentyl)methyl]acetamide
CID 103280419
N-[(3-hydroxycyclopentyl)methyl]cyclopropanecarboxamide
CID 103280320
N-[(3-hydroxycyclopentyl)methyl]-2-sulfanylacetamide
CID 106137763
2-bromo-N-[(3-hydroxycyclopentyl)methyl]-2-methylpropanamide
CID 106127935
2-amino-N-[(3-hydroxycyclopentyl)methyl]propanamide
CID 106134063
N-[(3-hydroxycyclopentyl)methyl]-2-sulfanylpropanamide
CID 106137756
N-[(3-hydroxycyclopentyl)methyl]-3,3-dimethylbutanamide
CID 103279887
1-[(3-hydroxycyclopentyl)methyl]-3-propylurea
CID 103207904
N-[(3-hydroxycyclopentyl)methyl]-4-oxopentanamide
CID 106135905
2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide
CID 103279737

Frequently Asked Questions

What is the IUPAC name of methyl N-[(3-hydroxycyclopentyl)methyl]carbamate?
The IUPAC name of methyl N-[(3-hydroxycyclopentyl)methyl]carbamate (CID 103279767) is methyl N-[(3-hydroxycyclopentyl)methyl]carbamate.
What is the SMILES notation for methyl N-[(3-hydroxycyclopentyl)methyl]carbamate?
The canonical SMILES for methyl N-[(3-hydroxycyclopentyl)methyl]carbamate is COC(=O)NCC1CCC(O)C1.
What is the InChIKey of methyl N-[(3-hydroxycyclopentyl)methyl]carbamate?
The InChIKey is PJLMFJOTPOKNRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3/c1-12-8(11)9-5-6-2-3-7(10)4-6/h6-7,10H,2-5H2,1H3,(H,9,11).
What are the key properties of methyl N-[(3-hydroxycyclopentyl)methyl]carbamate?
methyl N-[(3-hydroxycyclopentyl)methyl]carbamate has a molecular weight of 173.21 g/mol, XLogP of 0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[(3-hydroxycyclopentyl)methyl]carbamate is sourced from PubChem (CID 103279767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).