1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine

C13H26N2 — CID 43270236

IUPAC1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine
SMILESCCCN(C1CC1)C1(CN)CCCCC1
InChIInChI=1S/C13H26N2/c1-2-10-15(12-6-7-12)13(11-14)8-4-3-5-9-13/h12H,2-11,14H2,1H3
InChIKeyJAFJOKQXMOMRFJ-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.52
Rot. Bonds5

About 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine

1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine (PubChem CID 43270236) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine
PubChem CID43270236
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine
SMILESCCCN(C1CC1)C1(CN)CCCCC1
InChIInChI=1S/C13H26N2/c1-2-10-15(12-6-7-12)13(11-14)8-4-3-5-9-13/h12H,2-11,14H2,1H3
InChIKeyJAFJOKQXMOMRFJ-UHFFFAOYSA-N
XLogP2.52
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-cyclopropyl-N-ethylcyclooctan-1-amine
CID 43264050
1-(aminomethyl)-N-butyl-N-cyclopropylcyclobutan-1-amine
CID 79521257
4-(aminomethyl)-N-cyclopropyl-1-propan-2-yl-N-propylazepan-4-amine
CID 65078360
1-(aminomethyl)-N-cyclopropyl-N-propyl-4-(trifluoromethyl)cyclohexan-1-amine
CID 64753685
3-(aminomethyl)-N-cyclopropyl-N-propyloxolan-3-amine
CID 63335549
1-(aminomethyl)-N-butyl-N-cyclopropyl-4-ethylcycloheptan-1-amine
CID 65087923
4-(aminomethyl)-N-butyl-N-cyclopropyl-1-propylazepan-4-amine
CID 65078374
4-(aminomethyl)-N-cyclopropyl-N-ethyl-1-methylazepan-4-amine
CID 65075349
1-(aminomethyl)-N-butyl-N-cyclopropyl-3-(trifluoromethyl)cyclohexan-1-amine
CID 64759242
1-(aminomethyl)-N-pentyl-N-propylcyclohexan-1-amine
CID 62006023
1-(aminomethyl)-N-cyclopentyl-N,4-diethylcycloheptan-1-amine
CID 65088312
1-(aminomethyl)-N-heptyl-N-propylcyclohexan-1-amine
CID 63487162

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine (CID 43270236) is 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine is CCCN(C1CC1)C1(CN)CCCCC1.
What is the InChIKey of 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine?
The InChIKey is JAFJOKQXMOMRFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-10-15(12-6-7-12)13(11-14)8-4-3-5-9-13/h12H,2-11,14H2,1H3.
What are the key properties of 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine?
1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-cyclopropyl-N-propylcyclohexan-1-amine is sourced from PubChem (CID 43270236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).