1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine

C18H21N3 — CID 62956328

IUPAC1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine
SMILESCCCn1ccnc1CNCc1cccc2ccccc12
InChIInChI=1S/C18H21N3/c1-2-11-21-12-10-20-18(21)14-19-13-16-8-5-7-15-6-3-4-9-17(15)16/h3-10,12,19H,2,11,13-14H2,1H3
InChIKeyLGBOPDAWESIIFZ-UHFFFAOYSA-N
MW279.39 g/mol
LogP3.74
Rot. Bonds6

About 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine

1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine (PubChem CID 62956328) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine
PubChem CID62956328
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine
SMILESCCCn1ccnc1CNCc1cccc2ccccc12
InChIInChI=1S/C18H21N3/c1-2-11-21-12-10-20-18(21)14-19-13-16-8-5-7-15-6-3-4-9-17(15)16/h3-10,12,19H,2,11,13-14H2,1H3
InChIKeyLGBOPDAWESIIFZ-UHFFFAOYSA-N
XLogP3.74
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethylphenyl)-N-[(1-propylimidazol-2-yl)methyl]methanamine
CID 64680507
1-[2-(difluoromethoxy)phenyl]-N-[(1-propylimidazol-2-yl)methyl]methanamine
CID 62955769
N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895060
2-naphthalen-1-yl-1-(1-propylimidazol-2-yl)ethanone
CID 105100591
1-(2-methylpyrazol-3-yl)-N-[(1-propylimidazol-2-yl)methyl]methanamine
CID 63302358
2-methyl-2-phenyl-N-[(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 62956494
N-[(1-propylimidazol-2-yl)methyl]-1-(2H-tetrazol-5-yl)methanamine
CID 62957038
N-[(1-propylimidazol-2-yl)methyl]-1-[3-(trifluoromethyl)phenyl]methanamine
CID 62955935
N'-[(1-propylimidazol-2-yl)methyl]ethane-1,2-diamine
CID 62957721
2,6-dibromo-N-[(1-propylimidazol-2-yl)methyl]aniline
CID 107597049
2-(2-methoxyphenyl)-N-[(1-propylimidazol-2-yl)methyl]acetamide
CID 91768236
2-iodo-1-(naphthalen-1-ylmethyl)imidazole
CID 102402216

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine?
The IUPAC name of 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine (CID 62956328) is 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine.
What is the SMILES notation for 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine?
The canonical SMILES for 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine is CCCn1ccnc1CNCc1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine?
The InChIKey is LGBOPDAWESIIFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-2-11-21-12-10-20-18(21)14-19-13-16-8-5-7-15-6-3-4-9-17(15)16/h3-10,12,19H,2,11,13-14H2,1H3.
What are the key properties of 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine?
1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine has a molecular weight of 279.39 g/mol, XLogP of 3.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine is sourced from PubChem (CID 62956328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).