N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide

C10H20N2O — CID 121357646

IUPACN-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide
SMILESCC(=O)NCC1CC(NC(C)C)C1
InChIInChI=1S/C10H20N2O/c1-7(2)12-10-4-9(5-10)6-11-8(3)13/h7,9-10,12H,4-6H2,1-3H3,(H,11,13)
InChIKeyLRUACMSWYXMYOE-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.90
Rot. Bonds4

About N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide

N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide (PubChem CID 121357646) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide
PubChem CID121357646
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide
SMILESCC(=O)NCC1CC(NC(C)C)C1
InChIInChI=1S/C10H20N2O/c1-7(2)12-10-4-9(5-10)6-11-8(3)13/h7,9-10,12H,4-6H2,1-3H3,(H,11,13)
InChIKeyLRUACMSWYXMYOE-UHFFFAOYSA-N
XLogP0.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-propan-2-ylazetidin-3-yl)methyl]acetamide
CID 90251686
N-[[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide
CID 118428826
N-[[(1R,5S)-7-hydroxy-3-bicyclo[3.3.1]nonanyl]methyl]acetamide
CID 131879829
[(1R,3S)-3-(propan-2-ylamino)cyclopentyl]methanol
CID 170669831
N-[(3-ethylcyclohexyl)methyl]acetamide
CID 59811764
N-[[1-[(2S)-2-aminopropanoyl]piperidin-4-yl]methyl]acetamide
CID 66567593
1-[4-(acetamidomethyl)cyclohexyl]ethyl acetate
CID 174642719
N-[(1R,3S)-3-(propan-2-ylamino)cyclohexyl]acetamide
CID 139573748
N-[[(3R)-1-[(2S)-2-aminopropanoyl]piperidin-3-yl]methyl]acetamide
CID 96554564
N-[[(3S)-1-[(2S)-2-aminopropanoyl]piperidin-3-yl]methyl]acetamide
CID 96554565
potassium;carbanide;N-(piperidin-1-id-3-ylmethyl)acetamide
CID 153349366
N-(1,3-dioxan-5-ylmethyl)acetamide
CID 67192063

Frequently Asked Questions

What is the IUPAC name of N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide?
The IUPAC name of N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide (CID 121357646) is N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide.
What is the SMILES notation for N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide?
The canonical SMILES for N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide is CC(=O)NCC1CC(NC(C)C)C1.
What is the InChIKey of N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide?
The InChIKey is LRUACMSWYXMYOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-7(2)12-10-4-9(5-10)6-11-8(3)13/h7,9-10,12H,4-6H2,1-3H3,(H,11,13).
What are the key properties of N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide?
N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide has a molecular weight of 184.28 g/mol, XLogP of 0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(propan-2-ylamino)cyclobutyl]methyl]acetamide is sourced from PubChem (CID 121357646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).