N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine

C12H19NO — CID 107178330

IUPACN-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine
SMILESCC1CCCC1CNCc1ccco1
InChIInChI=1S/C12H19NO/c1-10-4-2-5-11(10)8-13-9-12-6-3-7-14-12/h3,6-7,10-11,13H,2,4-5,8-9H2,1H3
InChIKeyKAVFRJQRXXEHBX-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.81
Rot. Bonds4

About N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine

N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine (PubChem CID 107178330) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine
PubChem CID107178330
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC NameN-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine
SMILESCC1CCCC1CNCc1ccco1
InChIInChI=1S/C12H19NO/c1-10-4-2-5-11(10)8-13-9-12-6-3-7-14-12/h3,6-7,10-11,13H,2,4-5,8-9H2,1H3
InChIKeyKAVFRJQRXXEHBX-UHFFFAOYSA-N
XLogP2.81
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(furan-2-yl)-N-[(2-methylcyclohexyl)methyl]butan-2-amine
CID 55013434
N-(furan-2-ylmethyl)-1-(2-propan-2-yloxolan-3-yl)methanamine
CID 115677915
N-(furan-2-ylmethyl)-1-(oxan-2-yl)methanamine
CID 43403599
N-[(4-fluorophenyl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107416779
2-(furan-2-ylmethylamino)-N-(2-methylcyclohexyl)acetamide
CID 54773430
N-(furan-2-ylmethyl)-1-[(1R,2S,6R)-2,4,6-trimethylcyclohex-3-en-1-yl]methanamine
CID 1364525
N-(1-benzofuran-3-ylmethyl)-1-(2-methylcyclohexyl)methanamine
CID 80701390
N-[(3,5-dimethylphenyl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107417631
1-(1-ethylpiperidin-2-yl)-N-(furan-2-ylmethyl)methanamine
CID 115621753
2-[2-[[(2-methylcyclopentyl)methylamino]methyl]phenyl]acetic acid
CID 107418280
1-(2,3-dihydro-1H-inden-2-yl)-N-(furan-2-ylmethyl)methanamine
CID 103675715
2-[[(2-methylcyclopentyl)methylamino]methyl]benzonitrile
CID 114017972

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine?
The IUPAC name of N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine (CID 107178330) is N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine?
The canonical SMILES for N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine is CC1CCCC1CNCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine?
The InChIKey is KAVFRJQRXXEHBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-10-4-2-5-11(10)8-13-9-12-6-3-7-14-12/h3,6-7,10-11,13H,2,4-5,8-9H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine?
N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine has a molecular weight of 193.29 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine is sourced from PubChem (CID 107178330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).