N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine

C11H21N3O — CID 106565346

IUPACN-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine
SMILESCCCn1ccnc1NC(C)COCC
InChIInChI=1S/C11H21N3O/c1-4-7-14-8-6-12-11(14)13-10(3)9-15-5-2/h6,8,10H,4-5,7,9H2,1-3H3,(H,12,13)
InChIKeyDUYRYZUVBRWKKF-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.13
Rot. Bonds7

About N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine

N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine (PubChem CID 106565346) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine
PubChem CID106565346
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine
SMILESCCCn1ccnc1NC(C)COCC
InChIInChI=1S/C11H21N3O/c1-4-7-14-8-6-12-11(14)13-10(3)9-15-5-2/h6,8,10H,4-5,7,9H2,1-3H3,(H,12,13)
InChIKeyDUYRYZUVBRWKKF-UHFFFAOYSA-N
XLogP2.13
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-ethoxypropyl)-N-octan-2-ylimidazol-2-amine
CID 106564944
N-(1-methoxypropan-2-yl)-1-[2-(2-methylpropoxy)ethyl]imidazol-2-amine
CID 106582356
N-(1-methoxypropan-2-yl)-1-(3-methylbutyl)imidazol-2-amine
CID 106557283
3-N-[1-(3-ethoxypropyl)imidazol-2-yl]-1-N,1-N-dimethylbutane-1,3-diamine
CID 106567739
1-propyl-N-(1-thiophen-2-ylpropan-2-yl)imidazol-2-amine
CID 106573450
1-(2-butoxyethyl)-N-propan-2-ylimidazol-2-amine
CID 106568327
1-(3-ethoxypropyl)-N-(3-ethylpentan-2-yl)imidazol-2-amine
CID 106572232
N-(1-methoxypropan-2-yl)-1-(3-methylsulfanylbutyl)imidazol-2-amine
CID 106581674
1-pentyl-N-propan-2-ylimidazol-2-amine
CID 106556908
N-(1-ethoxypropan-2-yl)-2-propylpyrazol-3-amine
CID 115926039
1-butyl-N-(3-methylpentan-2-yl)imidazol-2-amine
CID 106564650
N-(1-methoxypropan-2-yl)-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572044

Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine?
The IUPAC name of N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine (CID 106565346) is N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine?
The canonical SMILES for N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine is CCCn1ccnc1NC(C)COCC.
What is the InChIKey of N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine?
The InChIKey is DUYRYZUVBRWKKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-4-7-14-8-6-12-11(14)13-10(3)9-15-5-2/h6,8,10H,4-5,7,9H2,1-3H3,(H,12,13).
What are the key properties of N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine?
N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine has a molecular weight of 211.31 g/mol, XLogP of 2.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine is sourced from PubChem (CID 106565346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).