N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide

C19H27N3O2 — CID 102554000

IUPACN-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide
SMILESCc1cccc(C2CCCN2C(=O)NC2CCOC(C3CC3)C2)n1
InChIInChI=1S/C19H27N3O2/c1-13-4-2-5-16(20-13)17-6-3-10-22(17)19(23)21-15-9-11-24-18(12-15)14-7-8-14/h2,4-5,14-15,17-18H,3,6-12H2,1H3,(H,21,23)
InChIKeyHIUPKXDSJDTPHK-UHFFFAOYSA-N
MW329.44 g/mol
LogP3.19
Rot. Bonds3

About N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide

N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide (PubChem CID 102554000) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide
PubChem CID102554000
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC NameN-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide
SMILESCc1cccc(C2CCCN2C(=O)NC2CCOC(C3CC3)C2)n1
InChIInChI=1S/C19H27N3O2/c1-13-4-2-5-16(20-13)17-6-3-10-22(17)19(23)21-15-9-11-24-18(12-15)14-7-8-14/h2,4-5,14-15,17-18H,3,6-12H2,1H3,(H,21,23)
InChIKeyHIUPKXDSJDTPHK-UHFFFAOYSA-N
XLogP3.19
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]ethanone
CID 102538999
cyclobutyl-[(2S)-2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]methanone
CID 95817448
N-[[1-(2,6-difluorophenyl)cyclopropyl]methyl]-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide
CID 102560985
N-[[1-(3-methoxyphenyl)cyclopropyl]methyl]-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide
CID 139004178
(2R)-N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 93070285
1-[(2S,4S)-2-cyclopropyloxan-4-yl]-3-(2-methyl-3-methylsulfanylphenyl)urea
CID 125137959
[5-methyl-1-(4-methylphenyl)triazol-4-yl]-[2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]methanone
CID 126776787
1-methyl-3-[3-[2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]-3-oxopropyl]benzimidazol-2-one
CID 136515688
(2S)-N-(3-methoxypropyl)-N-methyl-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide
CID 99831648
2,3-dihydro-1,4-benzodioxin-6-yl-[(2S)-2-[6-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]pyrrolidin-1-yl]methanone
CID 95835106
(2S)-N-cyclopentyl-2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carboxamide
CID 95116675
3-(1-methylpyrazol-3-yl)-1-[(2S)-2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]propan-1-one
CID 164632753

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide (CID 102554000) is N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide is Cc1cccc(C2CCCN2C(=O)NC2CCOC(C3CC3)C2)n1.
What is the InChIKey of N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide?
The InChIKey is HIUPKXDSJDTPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-13-4-2-5-16(20-13)17-6-3-10-22(17)19(23)21-15-9-11-24-18(12-15)14-7-8-14/h2,4-5,14-15,17-18H,3,6-12H2,1H3,(H,21,23).
What are the key properties of N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide?
N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide has a molecular weight of 329.44 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyloxan-4-yl)-2-(6-methyl-2-pyridinyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 102554000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).