N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide

C9H18N2O — CID 20782647

IUPACN,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide
SMILESCC(C)N1CCC1C(=O)N(C)C
InChIInChI=1S/C9H18N2O/c1-7(2)11-6-5-8(11)9(12)10(3)4/h7-8H,5-6H2,1-4H3
InChIKeyNLEHLVITGUCZMI-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.56
Rot. Bonds2

About N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide

N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide (PubChem CID 20782647) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide
PubChem CID20782647
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide
SMILESCC(C)N1CCC1C(=O)N(C)C
InChIInChI=1S/C9H18N2O/c1-7(2)11-6-5-8(11)9(12)10(3)4/h7-8H,5-6H2,1-4H3
InChIKeyNLEHLVITGUCZMI-UHFFFAOYSA-N
XLogP0.56
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide?
The IUPAC name of N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide (CID 20782647) is N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide is CC(C)N1CCC1C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide?
The InChIKey is NLEHLVITGUCZMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(2)11-6-5-8(11)9(12)10(3)4/h7-8H,5-6H2,1-4H3.
What are the key properties of N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide?
N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide has a molecular weight of 170.26 g/mol, XLogP of 0.56, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-propan-2-ylazetidine-2-carboxamide is sourced from PubChem (CID 20782647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).