N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine

C14H19FN4 — CID 103295528

IUPACN'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine
SMILESNCCN(c1nc2ccc(F)cc2[nH]1)C1CCCC1
InChIInChI=1S/C14H19FN4/c15-10-5-6-12-13(9-10)18-14(17-12)19(8-7-16)11-3-1-2-4-11/h5-6,9,11H,1-4,7-8,16H2,(H,17,18)
InChIKeyBAPIKXMRGSYEKX-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.41
Rot. Bonds4

About N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine

N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine (PubChem CID 103295528) has the molecular formula C14H19FN4 and a molecular weight of 262.33 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine
PubChem CID103295528
Molecular FormulaC14H19FN4
Molecular Weight262.33 g/mol
Exact Mass262.16
IUPAC NameN'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine
SMILESNCCN(c1nc2ccc(F)cc2[nH]1)C1CCCC1
InChIInChI=1S/C14H19FN4/c15-10-5-6-12-13(9-10)18-14(17-12)19(8-7-16)11-3-1-2-4-11/h5-6,9,11H,1-4,7-8,16H2,(H,17,18)
InChIKeyBAPIKXMRGSYEKX-UHFFFAOYSA-N
XLogP2.41
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(6-fluoro-1H-benzimidazol-2-yl)-N'-methylpropane-1,3-diamine
CID 103295352
N-(3-chloropropyl)-N-cyclobutyl-6-nitro-1H-benzimidazol-2-amine
CID 102871397
N-(2-bromoethyl)-6-fluoro-N-methyl-1H-benzimidazol-2-amine
CID 103295608
2-(6-fluoro-1H-benzimidazol-2-yl)ethanamine
CID 16767401
2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 64812865
1-cyclohexyl-N-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine
CID 103295345
6-fluoro-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1H-benzimidazol-2-amine
CID 106620594
6-[5-(4-chlorophenyl)-2-pyridinyl]-N-cyclopentyl-N-methyl-1H-benzimidazol-2-amine
CID 71022889
N-[1-(aminomethyl)-2-methylcyclohexyl]-6-fluoro-1H-benzimidazol-2-amine
CID 103295344
N-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl]cycloheptanamine
CID 82336950
N-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl]cyclooctanamine
CID 82336934
2-[(6-fluoro-1H-benzimidazol-2-yl)oxy]cycloheptan-1-amine
CID 103295496

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine (CID 103295528) is N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine is NCCN(c1nc2ccc(F)cc2[nH]1)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine?
The InChIKey is BAPIKXMRGSYEKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN4/c15-10-5-6-12-13(9-10)18-14(17-12)19(8-7-16)11-3-1-2-4-11/h5-6,9,11H,1-4,7-8,16H2,(H,17,18).
What are the key properties of N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine?
N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine has a molecular weight of 262.33 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(6-fluoro-1H-benzimidazol-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 103295528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).