1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine

C14H27N3 — CID 79496488

IUPAC1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine
SMILESCC(C)CC1CN=C(N)N1C1CCCCCC1
InChIInChI=1S/C14H27N3/c1-11(2)9-13-10-16-14(15)17(13)12-7-5-3-4-6-8-12/h11-13H,3-10H2,1-2H3,(H2,15,16)
InChIKeyQFGIIFJIKYWTKO-UHFFFAOYSA-N
MW237.39 g/mol
LogP2.75
Rot. Bonds3

About 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine

1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79496488) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine
PubChem CID79496488
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine
SMILESCC(C)CC1CN=C(N)N1C1CCCCCC1
InChIInChI=1S/C14H27N3/c1-11(2)9-13-10-16-14(15)17(13)12-7-5-3-4-6-8-12/h11-13H,3-10H2,1-2H3,(H2,15,16)
InChIKeyQFGIIFJIKYWTKO-UHFFFAOYSA-N
XLogP2.75
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5S)-1-butyl-5-(cyclohexylmethyl)-4,5-dihydroimidazol-2-amine
CID 23640800
(5R)-5-butyl-1-(2,2-dimethylpropyl)-4,5-dihydroimidazol-2-amine
CID 23640880
(5R)-1,5-dibutyl-4,5-dihydroimidazol-2-amine
CID 23640888
(5S)-5-butyl-1-[(4-methylcyclohexyl)methyl]-4,5-dihydroimidazol-2-amine
CID 145963370
(5S)-N,N,5-trimethyl-1-(4-methylpentyl)-4,5-dihydroimidazol-2-amine
CID 25102677
(5S)-5-butan-2-yl-1-(cyclohexylmethyl)-4,5-dihydroimidazol-2-amine
CID 23640799
(5S)-1-(cycloheptylmethyl)-N,N-dimethyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine
CID 25102558
(5S)-N,N-dimethyl-1,5-bis(2-methylpropyl)-4,5-dihydroimidazol-2-amine
CID 42601157
1-cycloheptyl-5-methyl-5-(4,4,4-trifluorobutyl)-4H-imidazol-2-amine
CID 116536432
N,N-dimethyl-1,5-bis(2-methylpropyl)-4,5-dihydroimidazol-2-amine
CID 73755340
1,5-Dibutyl-4,5-dihydroimidazol-2-amine
CID 73758754
5-Butyl-1-(2,2-dimethylpropyl)-4,5-dihydroimidazol-2-amine
CID 73758923

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine (CID 79496488) is 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine is CC(C)CC1CN=C(N)N1C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is QFGIIFJIKYWTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-11(2)9-13-10-16-14(15)17(13)12-7-5-3-4-6-8-12/h11-13H,3-10H2,1-2H3,(H2,15,16).
What are the key properties of 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine?
1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 237.39 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79496488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).