azane;[2-(2-methylpropyl)phenyl]methanamine

C11H20N2 — CID 174953175

IUPACazane;[2-(2-methylpropyl)phenyl]methanamine
SMILESCC(C)Cc1ccccc1CN.N
InChIInChI=1S/C11H17N.H3N/c1-9(2)7-10-5-3-4-6-11(10)8-12;/h3-6,9H,7-8,12H2,1-2H3;1H3
InChIKeyWNJRPIPODVKWCB-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.51
Rot. Bonds3

About azane;[2-(2-methylpropyl)phenyl]methanamine

azane;[2-(2-methylpropyl)phenyl]methanamine (PubChem CID 174953175) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is azane;[2-(2-methylpropyl)phenyl]methanamine.

Molecular Properties

Compound Nameazane;[2-(2-methylpropyl)phenyl]methanamine
PubChem CID174953175
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Nameazane;[2-(2-methylpropyl)phenyl]methanamine
SMILESCC(C)Cc1ccccc1CN.N
InChIInChI=1S/C11H17N.H3N/c1-9(2)7-10-5-3-4-6-11(10)8-12;/h3-6,9H,7-8,12H2,1-2H3;1H3
InChIKeyWNJRPIPODVKWCB-UHFFFAOYSA-N
XLogP2.51
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-bis(2-methylpropyl)benzene;hydrate
CID 172819121
N-[[2-(aminomethyl)phenyl]methyl]-N-butan-2-ylbutan-2-amine
CID 175214401
(2-propan-2-ylphenyl)methanamine
CID 15040708
[2-[(dimethylamino)methyl]phenyl]methanamine
CID 4962718
methane;1-methyl-2-(2-methylpropyl)benzene
CID 142148493
N-[[2-(aminomethyl)phenyl]methyl]-N-methylbutan-2-amine
CID 43272646
[2-(propan-2-yloxymethyl)phenyl]methanamine
CID 18070374
cesium 2-[2-(2-methylpropyl)phenyl]ethanolate
CID 145237019
(E)-3-[2-(2-methylpropyl)phenyl]prop-2-en-1-amine
CID 118428912
[2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]methanamine
CID 81318498
1-[(methyldisulfanyl)methyl]-2-(2-methylpropyl)benzene
CID 129072158
N-[[2-(2-methylpropyl)phenyl]methyl]ethanamine
CID 63887722

Frequently Asked Questions

What is the IUPAC name of azane;[2-(2-methylpropyl)phenyl]methanamine?
The IUPAC name of azane;[2-(2-methylpropyl)phenyl]methanamine (CID 174953175) is azane;[2-(2-methylpropyl)phenyl]methanamine.
What is the SMILES notation for azane;[2-(2-methylpropyl)phenyl]methanamine?
The canonical SMILES for azane;[2-(2-methylpropyl)phenyl]methanamine is CC(C)Cc1ccccc1CN.N.
What is the InChIKey of azane;[2-(2-methylpropyl)phenyl]methanamine?
The InChIKey is WNJRPIPODVKWCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.H3N/c1-9(2)7-10-5-3-4-6-11(10)8-12;/h3-6,9H,7-8,12H2,1-2H3;1H3.
What are the key properties of azane;[2-(2-methylpropyl)phenyl]methanamine?
azane;[2-(2-methylpropyl)phenyl]methanamine has a molecular weight of 180.29 g/mol, XLogP of 2.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;[2-(2-methylpropyl)phenyl]methanamine is sourced from PubChem (CID 174953175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).