1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine

C14H28N2 — CID 115257163

IUPAC1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine
SMILESCC(C)(CNCC1(N)CC1)C1CCCCC1
InChIInChI=1S/C14H28N2/c1-13(2,12-6-4-3-5-7-12)10-16-11-14(15)8-9-14/h12,16H,3-11,15H2,1-2H3
InChIKeyOZSHKKBDNLVNDJ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.67
Rot. Bonds5

About 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine

1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine (PubChem CID 115257163) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine
PubChem CID115257163
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine
SMILESCC(C)(CNCC1(N)CC1)C1CCCCC1
InChIInChI=1S/C14H28N2/c1-13(2,12-6-4-3-5-7-12)10-16-11-14(15)8-9-14/h12,16H,3-11,15H2,1-2H3
InChIKeyOZSHKKBDNLVNDJ-UHFFFAOYSA-N
XLogP2.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropane-1-carbonitrile
CID 115242683
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclobutyl-2-methylpropan-1-amine
CID 115244471
1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine
CID 115136380
N'-(2-cyclopentyl-2-methylpropyl)-2,2-dimethylpropane-1,3-diamine
CID 115200319
1-[[(2-cyclobutyl-2-methylpropyl)amino]methyl]cyclopropane-1-carbonitrile
CID 115242689
2-[(2-cyclohexyl-2-methylpropyl)amino]acetaldehyde
CID 115223611
2-[(2-cyclohexyl-2-methylpropyl)amino]ethanol
CID 115216597
1-[(2,2,3,3-tetramethylbutylamino)methyl]cyclopropan-1-amine
CID 115257108
3-[[(2-cyclopentyl-2-methylpropyl)amino]methyl]oxetane-3-carbonitrile
CID 115248258
2-cyclobutyl-N-(hydrazinylmethyl)-2-methylpropan-1-amine
CID 115261517
2-cycloheptyl-2-methylpropan-1-amine
CID 82934909
2-cyclohexyl-2-methylpropan-1-amine
CID 19776368

Frequently Asked Questions

What is the IUPAC name of 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine?
The IUPAC name of 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine (CID 115257163) is 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine?
The canonical SMILES for 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine is CC(C)(CNCC1(N)CC1)C1CCCCC1.
What is the InChIKey of 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine?
The InChIKey is OZSHKKBDNLVNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-13(2,12-6-4-3-5-7-12)10-16-11-14(15)8-9-14/h12,16H,3-11,15H2,1-2H3.
What are the key properties of 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine?
1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine is sourced from PubChem (CID 115257163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).