4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide

C23H26N4O — CID 70014718

IUPAC4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide
SMILESO=C(NC1CCc2ccccc21)C1CCC(Nc2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C23H26N4O/c28-22(25-19-14-11-15-5-1-2-6-18(15)19)16-9-12-17(13-10-16)24-23-26-20-7-3-4-8-21(20)27-23/h1-8,16-17,19H,9-14H2,(H,25,28)(H2,24,26,27)
InChIKeyJQYXJNFEQKJHIU-UHFFFAOYSA-N
MW374.49 g/mol
LogP4.34
Rot. Bonds4

About 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide

4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide (PubChem CID 70014718) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide
PubChem CID70014718
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide
SMILESO=C(NC1CCc2ccccc21)C1CCC(Nc2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C23H26N4O/c28-22(25-19-14-11-15-5-1-2-6-18(15)19)16-9-12-17(13-10-16)24-23-26-20-7-3-4-8-21(20)27-23/h1-8,16-17,19H,9-14H2,(H,25,28)(H2,24,26,27)
InChIKeyJQYXJNFEQKJHIU-UHFFFAOYSA-N
XLogP4.34
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 54.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1H-benzimidazol-2-ylamino)-N-methylcyclohexane-1-carboxamide
CID 18732356
N-(2,3-dihydro-1H-inden-1-yl)cyclobutanecarboxamide
CID 47129715
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cyclopropanecarboxamide
CID 7688429
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1H-benzimidazol-2-amine
CID 25157552
N-(1H-benzimidazol-2-yl)-2-(2,3-dihydro-1H-inden-1-yl)acetamide
CID 86955198
4-(1H-benzimidazol-2-ylamino)cyclohexan-1-one
CID 138676689
N-(1H-benzimidazol-2-yl)-4-hydroxycyclohexane-1-carboxamide
CID 112528043
N-cyclooctyl-1H-benzimidazol-2-amine
CID 46784683
(1S,5S)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 98289017
3-amino-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide
CID 63042687
N-(2,3-dihydro-1H-inden-1-yl)-3-quinolin-8-yloxycyclobutane-1-carboxamide
CID 139369320
2-(1H-benzimidazol-2-ylsulfanyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 4817958

Frequently Asked Questions

What is the IUPAC name of 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide (CID 70014718) is 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide is O=C(NC1CCc2ccccc21)C1CCC(Nc2nc3ccccc3[nH]2)CC1.
What is the InChIKey of 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide?
The InChIKey is JQYXJNFEQKJHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c28-22(25-19-14-11-15-5-1-2-6-18(15)19)16-9-12-17(13-10-16)24-23-26-20-7-3-4-8-21(20)27-23/h1-8,16-17,19H,9-14H2,(H,25,28)(H2,24,26,27).
What are the key properties of 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide?
4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide has a molecular weight of 374.49 g/mol, XLogP of 4.34, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-benzimidazol-2-ylamino)-N-(2,3-dihydro-1H-inden-1-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 70014718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).