N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide

C12H25N3O — CID 82938894

IUPACN-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide
SMILESCCN(C(=O)CNC(C)CN(C)C)C1CC1
InChIInChI=1S/C12H25N3O/c1-5-15(11-6-7-11)12(16)8-13-10(2)9-14(3)4/h10-11,13H,5-9H2,1-4H3
InChIKeyCANNSEREWDIYBH-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.54
Rot. Bonds7

About N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide

N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide (PubChem CID 82938894) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide
PubChem CID82938894
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide
SMILESCCN(C(=O)CNC(C)CN(C)C)C1CC1
InChIInChI=1S/C12H25N3O/c1-5-15(11-6-7-11)12(16)8-13-10(2)9-14(3)4/h10-11,13H,5-9H2,1-4H3
InChIKeyCANNSEREWDIYBH-UHFFFAOYSA-N
XLogP0.54
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-ethyl-2-(5-methylhexan-2-ylamino)acetamide
CID 63928127
2-(butan-2-ylamino)-N-cyclohexyl-N-ethylacetamide
CID 60684282
N-cyclopropyl-N-ethyl-2-(3-methylbutan-2-ylamino)acetamide
CID 61488088
2-[[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]amino]-3-methylbutanoic acid
CID 43468491
2-(butan-2-ylamino)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]acetamide
CID 54873874
N-cyclopropyl-N-ethyl-2-(3-methylbutylamino)acetamide
CID 60975211
N-cyclopropyl-N-ethyl-2-(pent-1-yn-3-ylamino)acetamide
CID 106229203
2-(butan-2-ylamino)-N-(2-cyanoethyl)-N-cyclopropylacetamide
CID 61040136
ethyl 2-[1-(dimethylamino)propan-2-ylamino]acetate
CID 82938567
2-[1-(dimethylamino)propan-2-ylamino]acetic acid
CID 82937754
N-benzyl-2-(butan-2-ylamino)-N-cyclopropylacetamide
CID 54925148
N-cyclopropyl-N-ethyl-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]acetamide
CID 81347384

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide?
The IUPAC name of N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide (CID 82938894) is N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide?
The canonical SMILES for N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide is CCN(C(=O)CNC(C)CN(C)C)C1CC1.
What is the InChIKey of N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide?
The InChIKey is CANNSEREWDIYBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-5-15(11-6-7-11)12(16)8-13-10(2)9-14(3)4/h10-11,13H,5-9H2,1-4H3.
What are the key properties of N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide?
N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide has a molecular weight of 227.35 g/mol, XLogP of 0.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide is sourced from PubChem (CID 82938894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).