N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide

C10H20N2O — CID 89425441

IUPACN-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide
SMILESCC(C)[C@H](C)N(C)C(=O)N1CCC1
InChIInChI=1S/C10H20N2O/c1-8(2)9(3)11(4)10(13)12-6-5-7-12/h8-9H,5-7H2,1-4H3/t9-/m0/s1
InChIKeyUJPPRPMZPCGHDD-VIFPVBQESA-N
MW184.28 g/mol
LogP1.79
Rot. Bonds2

About N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide

N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide (PubChem CID 89425441) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide
PubChem CID89425441
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide
SMILESCC(C)[C@H](C)N(C)C(=O)N1CCC1
InChIInChI=1S/C10H20N2O/c1-8(2)9(3)11(4)10(13)12-6-5-7-12/h8-9H,5-7H2,1-4H3/t9-/m0/s1
InChIKeyUJPPRPMZPCGHDD-VIFPVBQESA-N
XLogP1.79
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N,3-trimethylazetidine-1-carboxamide
CID 57537422
1,3-Di(propan-2-yl)-1,3-diazetidin-2-one
CID 58090970
4-Methyl-1,3-di(propan-2-yl)-1,3-diazetidin-2-one
CID 58090982
N-methyl-N-[(3S)-2,2,4-trimethylpentan-3-yl]azetidine-1-carboxamide
CID 58469200
1-(2,4-Dimethylpentan-3-yl)-1,3,3-trimethylurea
CID 58469260
N-(2,4-dimethylpentan-3-yl)-N-methylazetidine-1-carboxamide
CID 58469653
1,3-Dimethyl-1-(2-methylpropyl)-3-propan-2-ylurea
CID 59961769
N-methyl-N-(3-methylbutan-2-yl)azetidine-1-carboxamide
CID 68220889
N-methyl-N-(2,2,4-trimethylpentan-3-yl)azetidine-1-carboxamide
CID 68221672
N-(1-iodo-2-methylpropyl)-N-methylazetidine-1-carboxamide
CID 68246271
1-Methyl-1-(2-methylpropyl)-3,3-di(propan-2-yl)urea
CID 87304163
1,1,3-Trimethyl-3-(3-methylbutan-2-yl)urea
CID 88894836

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide?
The IUPAC name of N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide (CID 89425441) is N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide.
What is the SMILES notation for N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide?
The canonical SMILES for N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide is CC(C)[C@H](C)N(C)C(=O)N1CCC1.
What is the InChIKey of N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide?
The InChIKey is UJPPRPMZPCGHDD-VIFPVBQESA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(2)9(3)11(4)10(13)12-6-5-7-12/h8-9H,5-7H2,1-4H3/t9-/m0/s1.
What are the key properties of N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide?
N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2S)-3-methylbutan-2-yl]azetidine-1-carboxamide is sourced from PubChem (CID 89425441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).