2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide

C10H19N3O — CID 130757921

IUPAC2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide
SMILESCC(C(N)=O)N1CC2C(C1)C2N(C)C
InChIInChI=1S/C10H19N3O/c1-6(10(11)14)13-4-7-8(5-13)9(7)12(2)3/h6-9H,4-5H2,1-3H3,(H2,11,14)
InChIKeyDVVUWHGJOVFIIG-UHFFFAOYSA-N
MW197.28 g/mol
LogP-0.65
Rot. Bonds3

About 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide

2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide (PubChem CID 130757921) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide.

Molecular Properties

Compound Name2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide
PubChem CID130757921
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide
SMILESCC(C(N)=O)N1CC2C(C1)C2N(C)C
InChIInChI=1S/C10H19N3O/c1-6(10(11)14)13-4-7-8(5-13)9(7)12(2)3/h6-9H,4-5H2,1-3H3,(H2,11,14)
InChIKeyDVVUWHGJOVFIIG-UHFFFAOYSA-N
XLogP-0.65
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 5-0.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 99994089
2-(2,6-dimethylmorpholin-4-yl)propanamide
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CID 130686441
2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide
CID 131207561
(2S)-2-pyrrolidin-1-ylpropanamide
CID 39248173
2-pyrrolidin-1-ylpropanamide;dihydrochloride
CID 142642428
2-piperazin-1-ylpropanamide;dihydrochloride
CID 54593431
2-[(3aS,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrol-5-yl]propanamide
CID 64851610
2-[(3S)-3-methylpiperazin-1-yl]propanamide
CID 104976739
2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]propanamide
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2-(4-acetylpiperazin-1-yl)propanamide
CID 60644667

Frequently Asked Questions

What is the IUPAC name of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide?
The IUPAC name of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide (CID 130757921) is 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide.
What is the SMILES notation for 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide?
The canonical SMILES for 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide is CC(C(N)=O)N1CC2C(C1)C2N(C)C.
What is the InChIKey of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide?
The InChIKey is DVVUWHGJOVFIIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-6(10(11)14)13-4-7-8(5-13)9(7)12(2)3/h6-9H,4-5H2,1-3H3,(H2,11,14).
What are the key properties of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide?
2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide has a molecular weight of 197.28 g/mol, XLogP of -0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide is sourced from PubChem (CID 130757921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).