N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine

C17H27N3 — CID 79751005

IUPACN,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine
SMILESCCCn1c(CC(NC)C(C)CC)nc2ccccc21
InChIInChI=1S/C17H27N3/c1-5-11-20-16-10-8-7-9-14(16)19-17(20)12-15(18-4)13(3)6-2/h7-10,13,15,18H,5-6,11-12H2,1-4H3
InChIKeyLAUSUKFOMOFYSY-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.62
Rot. Bonds7

About N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine

N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine (PubChem CID 79751005) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine.

Molecular Properties

Compound NameN,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine
PubChem CID79751005
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC NameN,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine
SMILESCCCn1c(CC(NC)C(C)CC)nc2ccccc21
InChIInChI=1S/C17H27N3/c1-5-11-20-16-10-8-7-9-14(16)19-17(20)12-15(18-4)13(3)6-2/h7-10,13,15,18H,5-6,11-12H2,1-4H3
InChIKeyLAUSUKFOMOFYSY-UHFFFAOYSA-N
XLogP3.62
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-methoxy-1-(1-propylbenzimidazol-2-yl)pentan-2-yl]hydrazine
CID 105270881
1-propyl-2-[(1-propylbenzimidazol-2-yl)methyl]benzimidazole
CID 102471082
3-methoxy-1-(1-propylbenzimidazol-2-yl)butan-2-ol
CID 79753547
N,3,3-trimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine
CID 105007167
1,1-difluoro-N-propyl-3-(1-propylbenzimidazol-2-yl)propan-2-amine
CID 103516847
2-(4-bromo-2-methylpentyl)-1-propylbenzimidazole
CID 79751264
1-propyl-2-[(1-propylbenzimidazol-2-yl)methoxymethyl]benzimidazole
CID 11302951
1-butyl-2-(2-methylpropyl)benzimidazole
CID 4004972
N-methyl-2-(1-propylbenzimidazol-2-yl)-1-thiophen-3-ylethanamine
CID 79756302
3,3-dimethyl-1-(1-propylbenzimidazol-2-yl)butan-2-amine
CID 79754185
N,2-dimethyl-4-(1-propylbenzimidazol-2-yl)butan-1-amine
CID 79751254
[1,1,1-trifluoro-3-(1-propylbenzimidazol-2-yl)propan-2-yl]hydrazine
CID 105215870

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine?
The IUPAC name of N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine (CID 79751005) is N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine.
What is the SMILES notation for N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine?
The canonical SMILES for N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine is CCCn1c(CC(NC)C(C)CC)nc2ccccc21.
What is the InChIKey of N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine?
The InChIKey is LAUSUKFOMOFYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-5-11-20-16-10-8-7-9-14(16)19-17(20)12-15(18-4)13(3)6-2/h7-10,13,15,18H,5-6,11-12H2,1-4H3.
What are the key properties of N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine?
N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine has a molecular weight of 273.42 g/mol, XLogP of 3.62, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-amine is sourced from PubChem (CID 79751005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).