N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine

C15H26N2O — CID 79527667

IUPACN-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine
SMILESCC(Cc1ccco1)NCC1CCC(CN)CC1
InChIInChI=1S/C15H26N2O/c1-12(9-15-3-2-8-18-15)17-11-14-6-4-13(10-16)5-7-14/h2-3,8,12-14,17H,4-7,9-11,16H2,1H3
InChIKeyADBCNYBUIXJSKG-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.57
Rot. Bonds6

About N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine

N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine (PubChem CID 79527667) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine
PubChem CID79527667
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine
SMILESCC(Cc1ccco1)NCC1CCC(CN)CC1
InChIInChI=1S/C15H26N2O/c1-12(9-15-3-2-8-18-15)17-11-14-6-4-13(10-16)5-7-14/h2-3,8,12-14,17H,4-7,9-11,16H2,1H3
InChIKeyADBCNYBUIXJSKG-UHFFFAOYSA-N
XLogP2.57
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine with MolForge

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Related Compounds

1-(furan-2-yl)-N-(oxolan-3-ylmethyl)propan-2-amine
CID 43693110
1-(furan-2-yl)-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine
CID 63085135
2-[[1-(furan-2-yl)propan-2-ylamino]methyl]cyclopentan-1-amine
CID 64851073
4-[[1-(furan-2-yl)propan-2-ylamino]methyl]oxolan-3-amine
CID 66237936
N-[(4-ethylcyclohexyl)methyl]-4-(furan-2-yl)butan-2-amine
CID 55191977
4-N-[1-(furan-2-yl)propan-2-yl]cyclohexane-1,4-diamine
CID 63086190
1-(furan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)propan-2-amine
CID 106902071
1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966
4-[[1-(furan-2-yl)propan-2-ylamino]methyl]-N-methyloxolan-3-amine
CID 66247559
N-[1-(furan-2-yl)propan-2-yl]-2,3-dimethylbutan-1-amine
CID 64568053
N-(3-ethoxypropyl)-1-(furan-2-yl)propan-2-amine
CID 63099763
N-(1-cyclopentylethyl)-1-(furan-2-yl)propan-2-amine
CID 62634085

Frequently Asked Questions

What is the IUPAC name of N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine?
The IUPAC name of N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine (CID 79527667) is N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine.
What is the SMILES notation for N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine?
The canonical SMILES for N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine is CC(Cc1ccco1)NCC1CCC(CN)CC1.
What is the InChIKey of N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine?
The InChIKey is ADBCNYBUIXJSKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12(9-15-3-2-8-18-15)17-11-14-6-4-13(10-16)5-7-14/h2-3,8,12-14,17H,4-7,9-11,16H2,1H3.
What are the key properties of N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine?
N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(aminomethyl)cyclohexyl]methyl]-1-(furan-2-yl)propan-2-amine is sourced from PubChem (CID 79527667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).