N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide

C15H23N3O2 — CID 66255746

IUPACN-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)N(C)Cc1ccccn1
InChIInChI=1S/C15H23N3O2/c1-3-7-17-14-11-20-10-13(14)15(19)18(2)9-12-6-4-5-8-16-12/h4-6,8,13-14,17H,3,7,9-11H2,1-2H3
InChIKeyZJRHNEVOUXBXQS-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.05
Rot. Bonds6

About N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide

N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide (PubChem CID 66255746) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide
PubChem CID66255746
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)N(C)Cc1ccccn1
InChIInChI=1S/C15H23N3O2/c1-3-7-17-14-11-20-10-13(14)15(19)18(2)9-12-6-4-5-8-16-12/h4-6,8,13-14,17H,3,7,9-11H2,1-2H3
InChIKeyZJRHNEVOUXBXQS-UHFFFAOYSA-N
XLogP1.05
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-4-(methylamino)-N-(2-pyridin-2-ylethyl)oxolane-3-carboxamide
CID 66267541
N-ethyl-4-(propylamino)-N-pyridin-4-yloxolane-3-carboxamide
CID 106935566
4-(ethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methyloxolane-3-carboxamide
CID 66258931
N-methyl-N-[3-(methylamino)-3-oxopropyl]-4-(propylamino)oxolane-3-carboxamide
CID 106915220
trans-(1S,2S)-2-(furan-2-yl)-N-methyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 97314930
N-(4-cyanophenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66255223
4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide
CID 66266558
4-(methylamino)-N-(2-pyridin-2-ylethyl)oxolane-3-carboxamide
CID 66265963
4-(ethylamino)-N-[(3-fluorophenyl)methyl]-N-methyloxolane-3-carboxamide
CID 66258659
N-cyclohexyl-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66257070
1-[4-(propylamino)oxolan-3-yl]-2-pyridin-3-ylethanone
CID 116587805
2-[methyl-[4-(propylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66256930

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide (CID 66255746) is N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide is CCCNC1COCC1C(=O)N(C)Cc1ccccn1.
What is the InChIKey of N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
The InChIKey is ZJRHNEVOUXBXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-7-17-14-11-20-10-13(14)15(19)18(2)9-12-6-4-5-8-16-12/h4-6,8,13-14,17H,3,7,9-11H2,1-2H3.
What are the key properties of N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(propylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 66255746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).