2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine

C14H28N2 — CID 64736034

IUPAC2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
SMILESCC1CC(C)C(CN(C)CC2CC2)C(N)C1
InChIInChI=1S/C14H28N2/c1-10-6-11(2)13(14(15)7-10)9-16(3)8-12-4-5-12/h10-14H,4-9,15H2,1-3H3
InChIKeyKXDXPPDWFBIYCU-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.34
Rot. Bonds4

About 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine

2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine (PubChem CID 64736034) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
PubChem CID64736034
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
SMILESCC1CC(C)C(CN(C)CC2CC2)C(N)C1
InChIInChI=1S/C14H28N2/c1-10-6-11(2)13(14(15)7-10)9-16(3)8-12-4-5-12/h10-14H,4-9,15H2,1-3H3
InChIKeyKXDXPPDWFBIYCU-UHFFFAOYSA-N
XLogP2.34
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 64735863
2-[[3-methoxypropyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
CID 64736449
3,5-dimethyl-2-[[methyl-[(4-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine
CID 64737587
3,5-dimethyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 64735628
4-[[cyclopropylmethyl(methyl)amino]methyl]cyclohexan-1-amine
CID 60984087
2-[(dibutylamino)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64735424
2-[[(2-methoxyphenyl)methyl-methylamino]methyl]-3,5-dimethylcyclohexan-1-amine
CID 64736433
2-[[butyl(ethyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
CID 64735421
2-[(2-amino-4,6-dimethylcyclohexyl)methyl-ethylamino]ethanol
CID 64735435
1-[(2-amino-4,6-dimethylcyclohexyl)methyl-ethylamino]-2-methylpropan-2-ol
CID 79379942
2-[[2-methoxyethyl(propan-2-yl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
CID 82952445
1-[(2-amino-4,6-dimethylcyclohexyl)methyl]-N,N-dimethylpyrrolidin-3-amine
CID 64734685

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine?
The IUPAC name of 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine (CID 64736034) is 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine is CC1CC(C)C(CN(C)CC2CC2)C(N)C1.
What is the InChIKey of 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine?
The InChIKey is KXDXPPDWFBIYCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-10-6-11(2)13(14(15)7-10)9-16(3)8-12-4-5-12/h10-14H,4-9,15H2,1-3H3.
What are the key properties of 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine?
2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine has a molecular weight of 224.39 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 2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 64736034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).