1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one

C19H28N4O2 — CID 70756328

IUPAC1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one
SMILESCc1nccn1CCC1CCN(C(=O)C2CC(=O)N(C3CC3)C2)CC1
InChIInChI=1S/C19H28N4O2/c1-14-20-7-11-21(14)8-4-15-5-9-22(10-6-15)19(25)16-12-18(24)23(13-16)17-2-3-17/h7,11,15-17H,2-6,8-10,12-13H2,1H3
InChIKeyJZAXTERNTVFYBO-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.83
Rot. Bonds5

About 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one

1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one (PubChem CID 70756328) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one
PubChem CID70756328
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC Name1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one
SMILESCc1nccn1CCC1CCN(C(=O)C2CC(=O)N(C3CC3)C2)CC1
InChIInChI=1S/C19H28N4O2/c1-14-20-7-11-21(14)8-4-15-5-9-22(10-6-15)19(25)16-12-18(24)23(13-16)17-2-3-17/h7,11,15-17H,2-6,8-10,12-13H2,1H3
InChIKeyJZAXTERNTVFYBO-UHFFFAOYSA-N
XLogP1.83
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(Dimethylamino)-1-piperidinyl]-3-(1-methyl-1H-imidazol-2-yl)-1-propanone
CID 71738795
2-[4-[(1-Ethylimidazol-2-yl)methyl]piperazin-1-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 53559979
1-[3-(2-Methylimidazol-1-yl)piperidin-1-yl]-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propan-1-one
CID 53601583
1-(3-Imidazol-1-ylpiperidin-1-yl)-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propan-1-one
CID 53625250
1-(2-(4-((2-isopropyl-1H-imidazol-1-yl)methyl)piperidin-1-yl)-2-oxoethyl)pyrrolidine-2,5-dione
CID 56724045
1-[4-[[3-Methyl-4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methyl]piperidin-1-yl]ethanone
CID 56802163
4-(cyclopropylmethyl)-3-isopropyl-1-[(1-methyl-1H-imidazol-2-yl)methyl]-1,4-diazepan-5-one
CID 56865566
4-(cyclopropylmethyl)-3-isopropyl-1-[(1-isopropyl-1H-imidazol-2-yl)methyl]-1,4-diazepan-5-one
CID 56867908
4-(cyclopropylmethyl)-1-[(1-ethyl-1H-imidazol-2-yl)methyl]-3-isopropyl-1,4-diazepan-5-one
CID 56873299
4-[1-(cyclopropylmethyl)-1H-imidazol-2-yl]-1-[2-methyl-3-(1-pyrrolidinyl)propanoyl]piperidine
CID 70752396
N-({(2S,4S)-4-fluoro-1-[4-(2-methyl-1H-imidazol-1-yl)butanoyl]pyrrolidin-2-yl}methyl)-3-methylbutanamide
CID 70755207
4-[1-(cyclobutylmethyl)-1H-imidazol-2-yl]-1-[1-methyl-2-oxo-2-(1-pyrrolidinyl)ethyl]piperidine
CID 70765708

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one?
The IUPAC name of 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one (CID 70756328) is 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one.
What is the SMILES notation for 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one?
The canonical SMILES for 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one is Cc1nccn1CCC1CCN(C(=O)C2CC(=O)N(C3CC3)C2)CC1.
What is the InChIKey of 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one?
The InChIKey is JZAXTERNTVFYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-14-20-7-11-21(14)8-4-15-5-9-22(10-6-15)19(25)16-12-18(24)23(13-16)17-2-3-17/h7,11,15-17H,2-6,8-10,12-13H2,1H3.
What are the key properties of 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one?
1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one has a molecular weight of 344.46 g/mol, XLogP of 1.83, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-[4-[2-(2-methylimidazol-1-yl)ethyl]piperidine-1-carbonyl]pyrrolidin-2-one is sourced from PubChem (CID 70756328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).