1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine

C13H19N — CID 166794538

IUPAC1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine
SMILESCCC1(c2ccc(CNC)cc2)CC1
InChIInChI=1S/C13H19N/c1-3-13(8-9-13)12-6-4-11(5-7-12)10-14-2/h4-7,14H,3,8-10H2,1-2H3
InChIKeyNOUFUDXTYLBNKT-UHFFFAOYSA-N
MW189.30 g/mol
LogP2.85
Rot. Bonds4

About 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine

1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine (PubChem CID 166794538) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine
PubChem CID166794538
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine
SMILESCCC1(c2ccc(CNC)cc2)CC1
InChIInChI=1S/C13H19N/c1-3-13(8-9-13)12-6-4-11(5-7-12)10-14-2/h4-7,14H,3,8-10H2,1-2H3
InChIKeyNOUFUDXTYLBNKT-UHFFFAOYSA-N
XLogP2.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[4-[4-(dimethylamino)phenyl]-1,4-bis[4-(methylaminomethyl)phenyl]cyclohexyl]-N,N-dimethylaniline
CID 153497949
4-[4-(methylaminomethyl)phenyl]oxane-4-carbonitrile
CID 177016544
1-[4-(3-fluorothiolan-3-yl)phenyl]-N-methylmethanamine
CID 84725712
N-methyl-1-(4-propylphenyl)methanamine
CID 20666221
N-methoxy-1-[4-[1-(methoxymethyl)cyclopropyl]phenyl]methanamine
CID 117107426
ethane;N-methyl-1-(4-propylphenyl)methanamine
CID 176699852
ethane;N-methyl-1-(4-methylphenyl)methanamine;propane
CID 168988049
1-ethyl-4-[1-[[1-(4-ethylphenyl)cyclopropyl]methoxymethyl]cyclopropyl]benzene
CID 56620627
1-[1-(4-butylphenyl)cyclopentyl]-N-methylmethanamine
CID 112518490
N-methyl-2-[4-[1-(methylsulfonylmethyl)cyclopropyl]phenyl]ethanamine
CID 117108065
N-methyl-4-(methylaminomethyl)-N-propylaniline
CID 43281892
borane;N-methyl-1-phenylmethanamine
CID 134979061

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine (CID 166794538) is 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine is CCC1(c2ccc(CNC)cc2)CC1.
What is the InChIKey of 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine?
The InChIKey is NOUFUDXTYLBNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-3-13(8-9-13)12-6-4-11(5-7-12)10-14-2/h4-7,14H,3,8-10H2,1-2H3.
What are the key properties of 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine?
1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine has a molecular weight of 189.30 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-ethylcyclopropyl)phenyl]-N-methylmethanamine is sourced from PubChem (CID 166794538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).