10-(3H-benzimidazol-5-yl)decan-1-amine

C17H27N3 — CID 150986948

IUPAC10-(3H-benzimidazol-5-yl)decan-1-amine
SMILESNCCCCCCCCCCc1ccc2nc[nH]c2c1
InChIInChI=1S/C17H27N3/c18-12-8-6-4-2-1-3-5-7-9-15-10-11-16-17(13-15)20-14-19-16/h10-11,13-14H,1-9,12,18H2,(H,19,20)
InChIKeyLRHCEMKCVBPOER-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.18
Rot. Bonds10

About 10-(3H-benzimidazol-5-yl)decan-1-amine

10-(3H-benzimidazol-5-yl)decan-1-amine (PubChem CID 150986948) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 10-(3H-benzimidazol-5-yl)decan-1-amine.

Molecular Properties

Compound Name10-(3H-benzimidazol-5-yl)decan-1-amine
PubChem CID150986948
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC Name10-(3H-benzimidazol-5-yl)decan-1-amine
SMILESNCCCCCCCCCCc1ccc2nc[nH]c2c1
InChIInChI=1S/C17H27N3/c18-12-8-6-4-2-1-3-5-7-9-15-10-11-16-17(13-15)20-14-19-16/h10-11,13-14H,1-9,12,18H2,(H,19,20)
InChIKeyLRHCEMKCVBPOER-UHFFFAOYSA-N
XLogP4.18
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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CID 116925069
N'-(3H-benzimidazol-5-ylmethyl)-N'-methylbutane-1,4-diamine
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4-amino-N-[2-(3H-benzimidazol-5-yl)ethyl]-N-methylbutanamide
CID 115155498
3-(3H-benzimidazol-5-yl)propanoic acid;hydrochloride
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6-(3-methylbutyl)-1H-benzimidazole
CID 58439474
4-(3H-benzimidazol-5-yl)butan-2-one
CID 82405049
2-N-[2-(3H-benzimidazol-5-yl)ethyl]-2-methylpropane-1,2-diamine
CID 115132184
[4-[(3H-benzimidazol-5-ylmethylamino)methyl]phenyl]methanamine
CID 115213218
4-[3-(3H-benzimidazol-5-yl)propyl]morpholine
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3-N-[2-(3H-benzimidazol-5-yl)ethyl]-3-N-methylpropane-1,2,3-triamine
CID 115120132

Frequently Asked Questions

What is the IUPAC name of 10-(3H-benzimidazol-5-yl)decan-1-amine?
The IUPAC name of 10-(3H-benzimidazol-5-yl)decan-1-amine (CID 150986948) is 10-(3H-benzimidazol-5-yl)decan-1-amine.
What is the SMILES notation for 10-(3H-benzimidazol-5-yl)decan-1-amine?
The canonical SMILES for 10-(3H-benzimidazol-5-yl)decan-1-amine is NCCCCCCCCCCc1ccc2nc[nH]c2c1.
What is the InChIKey of 10-(3H-benzimidazol-5-yl)decan-1-amine?
The InChIKey is LRHCEMKCVBPOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c18-12-8-6-4-2-1-3-5-7-9-15-10-11-16-17(13-15)20-14-19-16/h10-11,13-14H,1-9,12,18H2,(H,19,20).
What are the key properties of 10-(3H-benzimidazol-5-yl)decan-1-amine?
10-(3H-benzimidazol-5-yl)decan-1-amine has a molecular weight of 273.42 g/mol, XLogP of 4.18, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(3H-benzimidazol-5-yl)decan-1-amine is sourced from PubChem (CID 150986948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).