N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide

C19H26N4O2 — CID 118739979

IUPACN,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide
SMILESCc1nc(CN2CCC2(CCCc2ccccn2)C(=O)N(C)C)co1
InChIInChI=1S/C19H26N4O2/c1-15-21-17(14-25-15)13-23-12-10-19(23,18(24)22(2)3)9-6-8-16-7-4-5-11-20-16/h4-5,7,11,14H,6,8-10,12-13H2,1-3H3
InChIKeyWBISRSXJDURQBA-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.43
Rot. Bonds7

About N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide

N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide (PubChem CID 118739979) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide
PubChem CID118739979
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide
SMILESCc1nc(CN2CCC2(CCCc2ccccn2)C(=O)N(C)C)co1
InChIInChI=1S/C19H26N4O2/c1-15-21-17(14-25-15)13-23-12-10-19(23,18(24)22(2)3)9-6-8-16-7-4-5-11-20-16/h4-5,7,11,14H,6,8-10,12-13H2,1-3H3
InChIKeyWBISRSXJDURQBA-UHFFFAOYSA-N
XLogP2.43
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

CID 44554611
CID 44554611
CID 11350407
CID 11350407
CID 44589367
CID 44589367
CID 71694302
CID 71694302
CID 95827459
CID 95827459
CID 95827460
CID 95827460
CID 118739978
CID 118739978
CID 95210403
CID 95210403
CID 132323030
CID 132323030
CID 161657266
CID 161657266
CID 163350135
CID 163350135
CID 168058076
CID 168058076

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
The IUPAC name of N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide (CID 118739979) is N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide is Cc1nc(CN2CCC2(CCCc2ccccn2)C(=O)N(C)C)co1.
What is the InChIKey of N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
The InChIKey is WBISRSXJDURQBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-15-21-17(14-25-15)13-23-12-10-19(23,18(24)22(2)3)9-6-8-16-7-4-5-11-20-16/h4-5,7,11,14H,6,8-10,12-13H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 2.43, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide is sourced from PubChem (CID 118739979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).