N-[(3-propylcyclohexyl)methyl]methanimine

C11H21N — CID 174320248

IUPACN-[(3-propylcyclohexyl)methyl]methanimine
SMILESC=NCC1CCCC(CCC)C1
InChIInChI=1S/C11H21N/c1-3-5-10-6-4-7-11(8-10)9-12-2/h10-11H,2-9H2,1H3
InChIKeyMOVKWFNZBXTUGE-UHFFFAOYSA-N
MW167.30 g/mol
LogP3.29
Rot. Bonds4

About N-[(3-propylcyclohexyl)methyl]methanimine

N-[(3-propylcyclohexyl)methyl]methanimine (PubChem CID 174320248) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-[(3-propylcyclohexyl)methyl]methanimine.

Molecular Properties

Compound NameN-[(3-propylcyclohexyl)methyl]methanimine
PubChem CID174320248
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-[(3-propylcyclohexyl)methyl]methanimine
SMILESC=NCC1CCCC(CCC)C1
InChIInChI=1S/C11H21N/c1-3-5-10-6-4-7-11(8-10)9-12-2/h10-11H,2-9H2,1H3
InChIKeyMOVKWFNZBXTUGE-UHFFFAOYSA-N
XLogP3.29
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-3-propylcyclohexane
CID 22129036
cis-(1R,3S)-1-methyl-3-propylcyclohexane
CID 154071124
3-propylbicyclo[5.1.0]octane
CID 123651402
1-chloro-3-propylcyclohexane
CID 64516368
1,3-dipentylcyclohexane
CID 54105663
trans-(1S,3S)-1-prop-1-en-2-yl-3-propylcyclohexane
CID 155697508
hydrazine;propylcyclobutane;hydrochloride
CID 18995287
1,3-diheptylcyclohexane
CID 19973333
propylcyclotetradecane
CID 90991550
N-methyl-5-[(3S)-3-propylcyclohexyl]pentan-1-amine
CID 156519662
formaldehyde;propylcyclohexane
CID 174845889
1-propyl-3-(trifluoromethyl)cyclohexane
CID 142650129

Frequently Asked Questions

What is the IUPAC name of N-[(3-propylcyclohexyl)methyl]methanimine?
The IUPAC name of N-[(3-propylcyclohexyl)methyl]methanimine (CID 174320248) is N-[(3-propylcyclohexyl)methyl]methanimine.
What is the SMILES notation for N-[(3-propylcyclohexyl)methyl]methanimine?
The canonical SMILES for N-[(3-propylcyclohexyl)methyl]methanimine is C=NCC1CCCC(CCC)C1.
What is the InChIKey of N-[(3-propylcyclohexyl)methyl]methanimine?
The InChIKey is MOVKWFNZBXTUGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-3-5-10-6-4-7-11(8-10)9-12-2/h10-11H,2-9H2,1H3.
What are the key properties of N-[(3-propylcyclohexyl)methyl]methanimine?
N-[(3-propylcyclohexyl)methyl]methanimine has a molecular weight of 167.30 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-propylcyclohexyl)methyl]methanimine is sourced from PubChem (CID 174320248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).