2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine

C16H30N2 — CID 104678804

IUPAC2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine
SMILESNCC1(CCNC(C2CC2)C2CC2)CCCCC1
InChIInChI=1S/C16H30N2/c17-12-16(8-2-1-3-9-16)10-11-18-15(13-4-5-13)14-6-7-14/h13-15,18H,1-12,17H2
InChIKeyPQRPUCOERUFVLR-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.06
Rot. Bonds7

About 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine

2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine (PubChem CID 104678804) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine
PubChem CID104678804
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine
SMILESNCC1(CCNC(C2CC2)C2CC2)CCCCC1
InChIInChI=1S/C16H30N2/c17-12-16(8-2-1-3-9-16)10-11-18-15(13-4-5-13)14-6-7-14/h13-15,18H,1-12,17H2
InChIKeyPQRPUCOERUFVLR-UHFFFAOYSA-N
XLogP3.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)cyclopropyl]methyl]-1,1-dicyclopropylmethanamine
CID 115453755
N-[2-[1-(aminomethyl)cyclohexyl]ethyl]cycloheptanamine
CID 113440233
N-[2-[1-(aminomethyl)cyclohexyl]ethyl]heptan-2-amine
CID 104678802
[1-(2-cyclohexylethyl)cycloheptyl]methanamine
CID 114193187
2-[1-(aminomethyl)cyclohexyl]-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
CID 104678972
1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine
CID 103903505
2-[1-(aminomethyl)cyclohexyl]-N-[(1-ethylcyclopropyl)methyl]ethanamine
CID 114100611
N-[[1-(aminomethyl)cyclohexyl]methyl]butan-2-amine
CID 115438135
1,1-dicyclopropyl-N-[(3-propylpiperidin-3-yl)methyl]methanamine
CID 63133124
[1-(aminomethyl)cyclohexyl]methanamine;platinum(2+);dichloride
CID 10250859
2-[1-(aminomethyl)cyclobutyl]-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
CID 81169943
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-2,2-dimethylcyclopropan-1-amine
CID 81170697

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine?
The IUPAC name of 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine (CID 104678804) is 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine.
What is the SMILES notation for 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine?
The canonical SMILES for 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine is NCC1(CCNC(C2CC2)C2CC2)CCCCC1.
What is the InChIKey of 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine?
The InChIKey is PQRPUCOERUFVLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c17-12-16(8-2-1-3-9-16)10-11-18-15(13-4-5-13)14-6-7-14/h13-15,18H,1-12,17H2.
What are the key properties of 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine?
2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine has a molecular weight of 250.43 g/mol, XLogP of 3.06, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclohexyl]-N-(dicyclopropylmethyl)ethanamine is sourced from PubChem (CID 104678804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).