N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide

C20H23N5O2 — CID 95193146

IUPACN-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC[C@H](OCc2ccccn2)C1)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C20H23N5O2/c26-19(24-20-22-17-8-1-2-9-18(17)23-20)13-25-11-5-7-16(12-25)27-14-15-6-3-4-10-21-15/h1-4,6,8-10,16H,5,7,11-14H2,(H2,22,23,24,26)/t16-/m0/s1
InChIKeyIYSMEGGGSKJTGQ-INIZCTEOSA-N
MW365.44 g/mol
LogP2.58
Rot. Bonds6

About N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide

N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide (PubChem CID 95193146) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide
PubChem CID95193146
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC NameN-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC[C@H](OCc2ccccn2)C1)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C20H23N5O2/c26-19(24-20-22-17-8-1-2-9-18(17)23-20)13-25-11-5-7-16(12-25)27-14-15-6-3-4-10-21-15/h1-4,6,8-10,16H,5,7,11-14H2,(H2,22,23,24,26)/t16-/m0/s1
InChIKeyIYSMEGGGSKJTGQ-INIZCTEOSA-N
XLogP2.58
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[1-(pyridin-4-ylmethyl)piperidin-3-yl]oxymethyl]pyridine
CID 56896073
2-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 97212090
N-[(1R)-1-(4-bromophenyl)ethyl]-2-[(3S)-3-(pyridin-2-ylmethoxy)pyrrolidin-1-yl]acetamide
CID 97020692
N-(1H-benzimidazol-2-yl)-2-[4-[(2S)-oxolane-2-carbonyl]-1,4-diazepan-1-yl]acetamide
CID 95215210
5-[[3-(pyridin-2-ylmethoxy)piperidin-1-yl]methyl]-2-pyrrolidin-1-ylpyrimidine
CID 56906695
2-(5-methylpyrazol-1-yl)-1-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethanone
CID 97134776
2-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 43981456
2-[[(3S)-3-ethoxypiperidin-1-yl]methyl]pyridine
CID 95632872
5-[[3-(pyridin-2-ylmethoxy)piperidin-1-yl]methyl]-2-pyrrolidin-1-yl-1,3-thiazole
CID 56914538
2-(2,3-dihydroindol-1-yl)-1-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethanone
CID 97115501
1-[2-[3-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]phenyl]ethanone
CID 91766002
N-(1H-benzimidazol-2-yl)-3-cyclopentylpropanamide
CID 4659981

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide (CID 95193146) is N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide is O=C(CN1CCC[C@H](OCc2ccccn2)C1)Nc1nc2ccccc2[nH]1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide?
The InChIKey is IYSMEGGGSKJTGQ-INIZCTEOSA-N. The full InChI is InChI=1S/C20H23N5O2/c26-19(24-20-22-17-8-1-2-9-18(17)23-20)13-25-11-5-7-16(12-25)27-14-15-6-3-4-10-21-15/h1-4,6,8-10,16H,5,7,11-14H2,(H2,22,23,24,26)/t16-/m0/s1.
What are the key properties of N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide?
N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide has a molecular weight of 365.44 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-2-[(3S)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]acetamide is sourced from PubChem (CID 95193146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).