1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine

C12H23NO — CID 3144577

IUPAC1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine
SMILESC1CCC(CNCC2CCCO2)CC1
InChIInChI=1S/C12H23NO/c1-2-5-11(6-3-1)9-13-10-12-7-4-8-14-12/h11-13H,1-10H2
InChIKeyFVMLUSPSOHJPPW-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.34
Rot. Bonds4

About 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine

1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine (PubChem CID 3144577) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine
PubChem CID3144577
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine
SMILESC1CCC(CNCC2CCCO2)CC1
InChIInChI=1S/C12H23NO/c1-2-5-11(6-3-1)9-13-10-12-7-4-8-14-12/h11-13H,1-10H2
InChIKeyFVMLUSPSOHJPPW-UHFFFAOYSA-N
XLogP2.34
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 ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 81931212
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CID 81931213
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CID 82833913
CID 82833913
CID 82834190
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CID 82835948

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine?
The IUPAC name of 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine (CID 3144577) is 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine.
What is the SMILES notation for 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine?
The canonical SMILES for 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine is C1CCC(CNCC2CCCO2)CC1.
What is the InChIKey of 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine?
The InChIKey is FVMLUSPSOHJPPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-2-5-11(6-3-1)9-13-10-12-7-4-8-14-12/h11-13H,1-10H2.
What are the key properties of 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine?
1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine has a molecular weight of 197.32 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(oxolan-2-ylmethyl)methanamine is sourced from PubChem (CID 3144577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).