2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine

C15H18N2 — CID 22891976

IUPAC2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine
SMILESCC(C)(C)N/N=C/c1cccc2ccccc12
InChIInChI=1S/C15H18N2/c1-15(2,3)17-16-11-13-9-6-8-12-7-4-5-10-14(12)13/h4-11,17H,1-3H3/b16-11+
InChIKeyGJBLOJGHQNBYET-LFIBNONCSA-N
MW226.32 g/mol
LogP3.56
Rot. Bonds2

About 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine

2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine (PubChem CID 22891976) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine
PubChem CID22891976
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine
SMILESCC(C)(C)N/N=C/c1cccc2ccccc12
InChIInChI=1S/C15H18N2/c1-15(2,3)17-16-11-13-9-6-8-12-7-4-5-10-14(12)13/h4-11,17H,1-3H3/b16-11+
InChIKeyGJBLOJGHQNBYET-LFIBNONCSA-N
XLogP3.56
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(E)-naphthalen-1-ylmethylideneamino]methanamine
CID 110337745
1,3-bis(naphthalen-1-ylmethylideneamino)thiourea
CID 5196948
N-(naphthalen-1-ylmethylideneamino)-4-(trifluoromethyl)aniline
CID 110842073
4-fluoro-N-(naphthalen-1-ylmethylideneamino)aniline
CID 78597503
N-[(E)-naphthalen-1-ylmethylideneamino]-N'-[(Z)-naphthalen-1-ylmethylideneamino]butanediamide
CID 92959506
1-naphthalen-1-yl-N-propan-2-ylmethanimine
CID 10352682
2-methyl-N-[(2-nitrophenyl)methylideneamino]propan-2-amine;hydrochloride
CID 73242777
N-[(E)-naphthalen-1-ylmethylideneamino]benzenecarbothioamide
CID 177496026
N-[(Z)-naphthalen-1-ylmethylideneamino]benzamide
CID 5397614
N-(2-methylpropyl)-N'-[(E)-naphthalen-1-ylmethylideneamino]oxamide
CID 46741717
2-bromo-N-(naphthalen-1-ylmethylideneamino)propanamide
CID 5046667
ethyl N-[(Z)-naphthalen-1-ylmethylideneamino]carbamate
CID 5399199

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine?
The IUPAC name of 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine (CID 22891976) is 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine is CC(C)(C)N/N=C/c1cccc2ccccc12.
What is the InChIKey of 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine?
The InChIKey is GJBLOJGHQNBYET-LFIBNONCSA-N. The full InChI is InChI=1S/C15H18N2/c1-15(2,3)17-16-11-13-9-6-8-12-7-4-5-10-14(12)13/h4-11,17H,1-3H3/b16-11+.
What are the key properties of 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine?
2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine has a molecular weight of 226.32 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine is sourced from PubChem (CID 22891976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).