1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine

C12H23NO — CID 62633315

IUPAC1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine
SMILESCC(NCC1CCCO1)C1CCCC1
InChIInChI=1S/C12H23NO/c1-10(11-5-2-3-6-11)13-9-12-7-4-8-14-12/h10-13H,2-9H2,1H3
InChIKeyPUQQQGBNFCALJF-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.33
Rot. Bonds4

About 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine

1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine (PubChem CID 62633315) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine
PubChem CID62633315
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine
SMILESCC(NCC1CCCO1)C1CCCC1
InChIInChI=1S/C12H23NO/c1-10(11-5-2-3-6-11)13-9-12-7-4-8-14-12/h10-13H,2-9H2,1H3
InChIKeyPUQQQGBNFCALJF-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-cyclohexyl-N-[[(2R)-oxolan-2-yl]methyl]ethanamine
CID 93283261
(1S)-1-cyclohexyl-N-[2-[(2S)-oxolan-2-yl]ethyl]ethanamine
CID 93468404
N-(oxolan-2-ylmethyl)propan-2-amine;hydrochloride
CID 172772952
N-[(1R)-1-cyclohexylethyl]-3-(oxolan-2-yl)propan-1-amine
CID 81385044
3-methyl-N-(oxolan-2-ylmethyl)butan-2-amine
CID 43179200
(1S)-1-cyclohexyl-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81384591
1,1-bis(oxolan-2-ylmethylamino)propan-2-ol
CID 90119922
2-N-[[(2S)-oxolan-2-yl]methyl]-1-N-propan-2-ylpropane-1,2-diamine
CID 104856010
1-cyclopropyl-N-(1,4-dioxan-2-ylmethyl)ethanamine
CID 61023563
4-cyclopentyl-N-(oxolan-2-ylmethyl)butan-2-amine
CID 115705992
2-(oxan-2-ylmethylamino)propane-1,3-diol
CID 65314164
3-(oxolan-2-ylmethylamino)butan-1-ol
CID 83177846

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
The IUPAC name of 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine (CID 62633315) is 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
The canonical SMILES for 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine is CC(NCC1CCCO1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
The InChIKey is PUQQQGBNFCALJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-10(11-5-2-3-6-11)13-9-12-7-4-8-14-12/h10-13H,2-9H2,1H3.
What are the key properties of 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine has a molecular weight of 197.32 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine is sourced from PubChem (CID 62633315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).