N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide

C18H17N3O — CID 167540628

IUPACN-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide
SMILESC=C1Nc2ccc(NC(=O)C3CCc4ccccc43)cc2N1
InChIInChI=1S/C18H17N3O/c1-11-19-16-9-7-13(10-17(16)20-11)21-18(22)15-8-6-12-4-2-3-5-14(12)15/h2-5,7,9-10,15,19-20H,1,6,8H2,(H,21,22)
InChIKeyLYZNVJMKOYKFBG-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.66
Rot. Bonds2

About N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide

N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide (PubChem CID 167540628) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide.

Molecular Properties

Compound NameN-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide
PubChem CID167540628
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide
SMILESC=C1Nc2ccc(NC(=O)C3CCc4ccccc43)cc2N1
InChIInChI=1S/C18H17N3O/c1-11-19-16-9-7-13(10-17(16)20-11)21-18(22)15-8-6-12-4-2-3-5-14(12)15/h2-5,7,9-10,15,19-20H,1,6,8H2,(H,21,22)
InChIKeyLYZNVJMKOYKFBG-UHFFFAOYSA-N
XLogP3.66
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(3-methylsulfanylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
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CID 131922894
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CID 95318911
N-(5-chloro-2-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 56581587
1-(4-bromophenyl)-3-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)urea
CID 165003152
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CID 47825629
methyl 2-[4-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]phenoxy]acetate
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cadmium;bis(2,3-dihydro-1H-indene-1-carboxylic acid)
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Frequently Asked Questions

What is the IUPAC name of N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide?
The IUPAC name of N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide (CID 167540628) is N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide.
What is the SMILES notation for N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide?
The canonical SMILES for N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide is C=C1Nc2ccc(NC(=O)C3CCc4ccccc43)cc2N1.
What is the InChIKey of N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide?
The InChIKey is LYZNVJMKOYKFBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c1-11-19-16-9-7-13(10-17(16)20-11)21-18(22)15-8-6-12-4-2-3-5-14(12)15/h2-5,7,9-10,15,19-20H,1,6,8H2,(H,21,22).
What are the key properties of N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide?
N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 3.66, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylidene-1,3-dihydrobenzimidazol-5-yl)-2,3-dihydro-1H-indene-1-carboxamide is sourced from PubChem (CID 167540628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).