4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide

C16H24N4O — CID 120565069

IUPAC4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
SMILESCCn1c(C(C)NC(=O)CCC(C)N)nc2ccccc21
InChIInChI=1S/C16H24N4O/c1-4-20-14-8-6-5-7-13(14)19-16(20)12(3)18-15(21)10-9-11(2)17/h5-8,11-12H,4,9-10,17H2,1-3H3,(H,18,21)
InChIKeyZRAJRCSIZBIODA-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.36
Rot. Bonds6

About 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide

4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide (PubChem CID 120565069) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
PubChem CID120565069
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
SMILESCCn1c(C(C)NC(=O)CCC(C)N)nc2ccccc21
InChIInChI=1S/C16H24N4O/c1-4-20-14-8-6-5-7-13(14)19-16(20)12(3)18-15(21)10-9-11(2)17/h5-8,11-12H,4,9-10,17H2,1-3H3,(H,18,21)
InChIKeyZRAJRCSIZBIODA-UHFFFAOYSA-N
XLogP2.36
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
CID 60597479
3-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]-3-phenylpropanamide;dihydrochloride
CID 119953447
2-ethyl-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]butanamide
CID 16968998
N-[(1S)-1-[1-(2-methylpropyl)benzimidazol-2-yl]ethyl]propanamide
CID 751204
N-[(1S)-1-(1-pentylbenzimidazol-2-yl)ethyl]butanamide
CID 7023923
1-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]cyclopropane-1-carboxamide
CID 119866200
N-[(1R)-1-(1-propylbenzimidazol-2-yl)ethyl]propanamide
CID 751155
N-[(1R)-1-(1-ethylbenzimidazol-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 95234003
N-[1-(1-ethylbenzimidazol-2-yl)ethyl]-2-methyl-3-(methylamino)propanamide
CID 119866240
N-[1-(1-phenacylbenzimidazol-2-yl)ethyl]butanamide
CID 16968848
N-[(1S)-1-(1-ethylbenzimidazol-2-yl)ethyl]thiophene-2-carboxamide
CID 7025686
3-phenyl-N-[1-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]propanamide
CID 16970469

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
The IUPAC name of 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide (CID 120565069) is 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide.
What is the SMILES notation for 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
The canonical SMILES for 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide is CCn1c(C(C)NC(=O)CCC(C)N)nc2ccccc21.
What is the InChIKey of 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
The InChIKey is ZRAJRCSIZBIODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-4-20-14-8-6-5-7-13(14)19-16(20)12(3)18-15(21)10-9-11(2)17/h5-8,11-12H,4,9-10,17H2,1-3H3,(H,18,21).
What are the key properties of 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide has a molecular weight of 288.39 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide is sourced from PubChem (CID 120565069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).