N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide

C8H17N3O — CID 164713767

IUPACN-[3-(propan-2-ylamino)azetidin-1-yl]acetamide
SMILESCC(=O)NN1CC(NC(C)C)C1
InChIInChI=1S/C8H17N3O/c1-6(2)9-8-4-11(5-8)10-7(3)12/h6,8-9H,4-5H2,1-3H3,(H,10,12)
InChIKeyAHCZUIQEHQURBE-UHFFFAOYSA-N
MW171.24 g/mol
LogP-0.28
Rot. Bonds3

About N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide

N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide (PubChem CID 164713767) has the molecular formula C8H17N3O and a molecular weight of 171.24 g/mol. Its IUPAC name is N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[3-(propan-2-ylamino)azetidin-1-yl]acetamide
PubChem CID164713767
Molecular FormulaC8H17N3O
Molecular Weight171.24 g/mol
Exact Mass171.14
IUPAC NameN-[3-(propan-2-ylamino)azetidin-1-yl]acetamide
SMILESCC(=O)NN1CC(NC(C)C)C1
InChIInChI=1S/C8H17N3O/c1-6(2)9-8-4-11(5-8)10-7(3)12/h6,8-9H,4-5H2,1-3H3,(H,10,12)
InChIKeyAHCZUIQEHQURBE-UHFFFAOYSA-N
XLogP-0.28
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methoxyazetidin-1-yl)acetamide
CID 142684133
1-methyl-N-propan-2-ylazetidin-3-amine
CID 129045420
N-pyrrolidin-1-ylacetamide
CID 22023174
N-(azetidin-1-yl)acetamide
CID 54074158
1-[(3R)-3-(propan-2-ylamino)piperidin-1-yl]ethanone
CID 66569291
N-[(1R,3S)-3-(propan-2-ylamino)cyclohexyl]acetamide
CID 139573748
1-methylsulfonyl-N-propan-2-ylazetidin-3-amine
CID 130416289
(3R)-3-(propan-2-ylamino)piperidine-1-carboxylic acid
CID 67330926
N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide
CID 121357646
1-tert-butyl-N-propan-2-ylazetidin-3-amine
CID 130287809
2-methyl-1-[4-(propan-2-ylamino)piperidin-1-yl]propan-1-one
CID 43747822
2-amino-4-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 118410160

Frequently Asked Questions

What is the IUPAC name of N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide?
The IUPAC name of N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide (CID 164713767) is N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide.
What is the SMILES notation for N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide?
The canonical SMILES for N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide is CC(=O)NN1CC(NC(C)C)C1.
What is the InChIKey of N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide?
The InChIKey is AHCZUIQEHQURBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O/c1-6(2)9-8-4-11(5-8)10-7(3)12/h6,8-9H,4-5H2,1-3H3,(H,10,12).
What are the key properties of N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide?
N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide has a molecular weight of 171.24 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(propan-2-ylamino)azetidin-1-yl]acetamide is sourced from PubChem (CID 164713767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).