2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine

C12H23NO — CID 64908944

IUPAC2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
SMILESCC1CCC(NCC2CCCO2)C1C
InChIInChI=1S/C12H23NO/c1-9-5-6-12(10(9)2)13-8-11-4-3-7-14-11/h9-13H,3-8H2,1-2H3
InChIKeyQXCRKYHPYDSMDN-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.19
Rot. Bonds3

About 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine

2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine (PubChem CID 64908944) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
PubChem CID64908944
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
SMILESCC1CCC(NCC2CCCO2)C1C
InChIInChI=1S/C12H23NO/c1-9-5-6-12(10(9)2)13-8-11-4-3-7-14-11/h9-13H,3-8H2,1-2H3
InChIKeyQXCRKYHPYDSMDN-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-2-methyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
CID 64921005
N-(1,3-dioxan-4-ylmethyl)-2,3-dimethylcyclopentan-1-amine
CID 81102186
2,4-dimethyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 63995122
(2R,3R)-2-methyl-N-[[(2S)-oxolan-2-yl]methyl]oxolan-3-amine
CID 97358136
2-methyl-N-(oxan-2-ylmethyl)cyclopentan-1-amine
CID 63278391
2,5-dimethyl-N-(oxan-2-ylmethyl)cyclohexan-1-amine
CID 64761101
(2S,6S)-2,6-dimethyl-N-[[(2S)-oxolan-2-yl]methyl]oxan-4-amine
CID 97358325
1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine
CID 43665432
cis-(1R,2R)-2-ethyl-N-[[(2R)-oxolan-2-yl]methyl]cyclohexan-1-amine
CID 124710143
1-[(1R,2R,3R)-2,3-dimethylcyclohexyl]-3-[[(2S)-oxolan-2-yl]methylcarbamothioylamino]thiourea
CID 11933358
2-methoxy-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 43765488
1-N-methyl-4-N-(oxolan-2-ylmethyl)cyclohexane-1,4-diamine
CID 117027418

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine (CID 64908944) is 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine is CC1CCC(NCC2CCCO2)C1C.
What is the InChIKey of 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
The InChIKey is QXCRKYHPYDSMDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9-5-6-12(10(9)2)13-8-11-4-3-7-14-11/h9-13H,3-8H2,1-2H3.
What are the key properties of 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine has a molecular weight of 197.32 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 64908944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).