(3-aminocyclopentyl) N-propylcarbamate

C9H18N2O2 — CID 79464809

IUPAC(3-aminocyclopentyl) N-propylcarbamate
SMILESCCCNC(=O)OC1CCC(N)C1
InChIInChI=1S/C9H18N2O2/c1-2-5-11-9(12)13-8-4-3-7(10)6-8/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeyNERATAWNXZIXRV-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.00
Rot. Bonds3

About (3-aminocyclopentyl) N-propylcarbamate

(3-aminocyclopentyl) N-propylcarbamate (PubChem CID 79464809) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is (3-aminocyclopentyl) N-propylcarbamate.

Molecular Properties

Compound Name(3-aminocyclopentyl) N-propylcarbamate
PubChem CID79464809
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name(3-aminocyclopentyl) N-propylcarbamate
SMILESCCCNC(=O)OC1CCC(N)C1
InChIInChI=1S/C9H18N2O2/c1-2-5-11-9(12)13-8-4-3-7(10)6-8/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeyNERATAWNXZIXRV-UHFFFAOYSA-N
XLogP1.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl N-butylcarbamate
CID 165447718
(3-aminocyclopentyl) N-propan-2-ylcarbamate
CID 79465230
cyclopropyl N-(2-aminoethyl)carbamate
CID 105428634
(1-methylpiperidin-3-yl) N-propylcarbamate
CID 86158390
[(1R,3R)-3-aminocyclopentyl] carbamate
CID 154024517
[(3S)-3-aminocyclopentyl] carbamate
CID 175196107
ethyl N-propylcarbamate
CID 12199
1-[3-(4-aminocyclohexyl)oxypropyl]-3-propylurea
CID 63870768
bis[(1R,3S)-3-aminocyclopentyl] 2,3-dihydroxybutanedioate
CID 175006721
2-(4-amino-2-methylpiperidin-1-yl)-N-propylpropanamide
CID 115313029
(4-sulfanylcyclohexyl) N-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
CID 142542065
ethyl 2-(3-aminocyclopentyl)oxyacetate
CID 106940565

Frequently Asked Questions

What is the IUPAC name of (3-aminocyclopentyl) N-propylcarbamate?
The IUPAC name of (3-aminocyclopentyl) N-propylcarbamate (CID 79464809) is (3-aminocyclopentyl) N-propylcarbamate.
What is the SMILES notation for (3-aminocyclopentyl) N-propylcarbamate?
The canonical SMILES for (3-aminocyclopentyl) N-propylcarbamate is CCCNC(=O)OC1CCC(N)C1.
What is the InChIKey of (3-aminocyclopentyl) N-propylcarbamate?
The InChIKey is NERATAWNXZIXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-2-5-11-9(12)13-8-4-3-7(10)6-8/h7-8H,2-6,10H2,1H3,(H,11,12).
What are the key properties of (3-aminocyclopentyl) N-propylcarbamate?
(3-aminocyclopentyl) N-propylcarbamate has a molecular weight of 186.25 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminocyclopentyl) N-propylcarbamate is sourced from PubChem (CID 79464809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).