(2-butylcyclopentyl)carbamic acid

C10H19NO2 — CID 142463044

IUPAC(2-butylcyclopentyl)carbamic acid
SMILESCCCCC1CCCC1NC(=O)O
InChIInChI=1S/C10H19NO2/c1-2-3-5-8-6-4-7-9(8)11-10(12)13/h8-9,11H,2-7H2,1H3,(H,12,13)
InChIKeyLNQYJPCGNXYHNE-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.61
Rot. Bonds4

About (2-butylcyclopentyl)carbamic acid

(2-butylcyclopentyl)carbamic acid (PubChem CID 142463044) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (2-butylcyclopentyl)carbamic acid.

Molecular Properties

Compound Name(2-butylcyclopentyl)carbamic acid
PubChem CID142463044
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(2-butylcyclopentyl)carbamic acid
SMILESCCCCC1CCCC1NC(=O)O
InChIInChI=1S/C10H19NO2/c1-2-3-5-8-6-4-7-9(8)11-10(12)13/h8-9,11H,2-7H2,1H3,(H,12,13)
InChIKeyLNQYJPCGNXYHNE-UHFFFAOYSA-N
XLogP2.61
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-[(1R,2S)-2-butylcyclopentyl]-1-ethyl-1-methylurea
CID 95338254
N-[(1S,2S)-2-butylcyclopentyl]-3-methylbut-2-enamide
CID 95244402
N-(2-butylcyclopentyl)piperidine-4-carboxamide;hydrochloride
CID 119316653
[(1R,2R)-2-(hydroxymethyl)cyclohexyl]carbamic acid
CID 141194189
2-[[3-[(2-butylcyclopentyl)carbamoylamino]cyclobutyl]-ethylamino]acetic acid
CID 122000564
N-[1-[(2-butylcyclopentyl)amino]-3-hydroxy-1-oxobutan-2-yl]cyclopropanecarboxamide
CID 110014490
1-butyl-2-ethylcyclopentane
CID 522474
[(1R,2S)-2-(aminomethyl)cyclohexyl]carbamic acid
CID 124566827
[(1S,2R)-2-(aminomethyl)cyclohexyl]carbamic acid
CID 124566826
N-(2-ethylcyclopentyl)acetamide
CID 130891213
7-[(1S)-2-(heptylamino)cyclopentyl]heptanoic acid
CID 10041163
2-butyl-N-methylcyclohexan-1-amine;propan-1-ol
CID 71071796

Frequently Asked Questions

What is the IUPAC name of (2-butylcyclopentyl)carbamic acid?
The IUPAC name of (2-butylcyclopentyl)carbamic acid (CID 142463044) is (2-butylcyclopentyl)carbamic acid.
What is the SMILES notation for (2-butylcyclopentyl)carbamic acid?
The canonical SMILES for (2-butylcyclopentyl)carbamic acid is CCCCC1CCCC1NC(=O)O.
What is the InChIKey of (2-butylcyclopentyl)carbamic acid?
The InChIKey is LNQYJPCGNXYHNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-2-3-5-8-6-4-7-9(8)11-10(12)13/h8-9,11H,2-7H2,1H3,(H,12,13).
What are the key properties of (2-butylcyclopentyl)carbamic acid?
(2-butylcyclopentyl)carbamic acid has a molecular weight of 185.27 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-butylcyclopentyl)carbamic acid is sourced from PubChem (CID 142463044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).