3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide

C12H25N3O2 — CID 114150174

IUPAC3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide
SMILESCN(C)CC(C)(O)CNC(=O)CC(N)C1CC1
InChIInChI=1S/C12H25N3O2/c1-12(17,8-15(2)3)7-14-11(16)6-10(13)9-4-5-9/h9-10,17H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyQIKPZBCIVRQHGD-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.46
Rot. Bonds7

About 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide

3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide (PubChem CID 114150174) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide.

Molecular Properties

Compound Name3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide
PubChem CID114150174
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide
SMILESCN(C)CC(C)(O)CNC(=O)CC(N)C1CC1
InChIInChI=1S/C12H25N3O2/c1-12(17,8-15(2)3)7-14-11(16)6-10(13)9-4-5-9/h9-10,17H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyQIKPZBCIVRQHGD-UHFFFAOYSA-N
XLogP-0.46
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3,4,4-trimethylpentanamide
CID 113322168
3-amino-3-cyclopropyl-N-(4-hydroxy-2,2-dimethylbutyl)propanamide
CID 106148074
3-amino-3-cyclopropyl-N',N'-dimethylpropanehydrazide
CID 83020966
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide
CID 103525819
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-propan-2-yloxyacetamide
CID 103840231
3-amino-3-cyclopropyl-N-(2,3,3-trimethylbutyl)propanamide
CID 83141491
ethyl 4-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-4-oxobutanoate
CID 103839873
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
CID 106148529
4-cyclohexyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]butanamide
CID 103839791
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide
CID 106148441
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]cyclooctanecarboxamide
CID 103840050
1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol
CID 115895807

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide?
The IUPAC name of 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide (CID 114150174) is 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide.
What is the SMILES notation for 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide?
The canonical SMILES for 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide is CN(C)CC(C)(O)CNC(=O)CC(N)C1CC1.
What is the InChIKey of 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide?
The InChIKey is QIKPZBCIVRQHGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-12(17,8-15(2)3)7-14-11(16)6-10(13)9-4-5-9/h9-10,17H,4-8,13H2,1-3H3,(H,14,16).
What are the key properties of 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide?
3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide has a molecular weight of 243.35 g/mol, XLogP of -0.46, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide is sourced from PubChem (CID 114150174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).