N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide

C20H26N4O — CID 91833281

IUPACN-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
SMILESO=C(CCN1CCC(c2ccn[nH]2)CC1)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C20H26N4O/c25-20(22-18-5-4-15-2-1-3-17(15)14-18)9-13-24-11-7-16(8-12-24)19-6-10-21-23-19/h4-6,10,14,16H,1-3,7-9,11-13H2,(H,21,23)(H,22,25)
InChIKeyFQYPAHWYYPLDSE-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.11
Rot. Bonds5

About N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide

N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide (PubChem CID 91833281) has the molecular formula C20H26N4O and a molecular weight of 338.45 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
PubChem CID91833281
Molecular FormulaC20H26N4O
Molecular Weight338.45 g/mol
Exact Mass338.21
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
SMILESO=C(CCN1CCC(c2ccn[nH]2)CC1)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C20H26N4O/c25-20(22-18-5-4-15-2-1-3-17(15)14-18)9-13-24-11-7-16(8-12-24)19-6-10-21-23-19/h4-6,10,14,16H,1-3,7-9,11-13H2,(H,21,23)(H,22,25)
InChIKeyFQYPAHWYYPLDSE-UHFFFAOYSA-N
XLogP3.11
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-pyridinyl)-1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxopropyl]piperidine-4-carboxamide
CID 56525559
N-(2,3-dihydro-1H-inden-5-yl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propanamide
CID 771735
N-(2,3-dihydro-1H-inden-5-yl)-3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 771738
N-[1-[3-(2,3-dihydro-1H-inden-5-ylamino)-3-oxopropyl]piperidin-4-yl]thiophene-2-carboxamide
CID 47547962
N-(2,3-dihydro-1H-inden-5-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)pyrrolidin-1-yl]propanamide
CID 91841564
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 81492316
N-(2,3-dihydro-1H-inden-5-yl)-3-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]propanamide
CID 91838658
N-(2,3-dihydro-1H-inden-5-yl)-2-pyrrolidin-1-ylacetamide
CID 1429488
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(2,3-dihydro-1H-inden-5-yl)acetamide;hydrochloride
CID 119933929
2,3-dihydro-1H-inden-5-yl-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 124605887
N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide
CID 60650065
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
CID 124757594

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide (CID 91833281) is N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide is O=C(CCN1CCC(c2ccn[nH]2)CC1)Nc1ccc2c(c1)CCC2.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The InChIKey is FQYPAHWYYPLDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c25-20(22-18-5-4-15-2-1-3-17(15)14-18)9-13-24-11-7-16(8-12-24)19-6-10-21-23-19/h4-6,10,14,16H,1-3,7-9,11-13H2,(H,21,23)(H,22,25).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide has a molecular weight of 338.45 g/mol, XLogP of 3.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide is sourced from PubChem (CID 91833281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).