1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine

C10H17N3S — CID 106580964

IUPAC1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine
SMILESCSC(C)CNc1nccn1C1CC1
InChIInChI=1S/C10H17N3S/c1-8(14-2)7-12-10-11-5-6-13(10)9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3,(H,11,12)
InChIKeyFTLGTSHUPIEMLX-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.38
Rot. Bonds5

About 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine

1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine (PubChem CID 106580964) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine
PubChem CID106580964
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine
SMILESCSC(C)CNc1nccn1C1CC1
InChIInChI=1S/C10H17N3S/c1-8(14-2)7-12-10-11-5-6-13(10)9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3,(H,11,12)
InChIKeyFTLGTSHUPIEMLX-UHFFFAOYSA-N
XLogP2.38
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-N-(2,3-dimethylbutyl)imidazol-2-amine
CID 106575250
1-cyclopropyl-N-propylimidazol-2-amine
CID 106554744
1-cyclopentyl-N-(2-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106577815
1-cyclopropyl-N-(3-methylsulfinylbutyl)imidazol-2-amine
CID 106580270
N-(1-cyclopropylimidazol-2-yl)-N'-methyl-N'-propan-2-ylbutane-1,4-diamine
CID 106565754
1-cyclopropyl-N-(2-methylsulfinylethyl)imidazol-2-amine
CID 106581393
1-cyclopropyl-N-(4-propan-2-ylphenyl)imidazol-2-amine
CID 106557354
1-cyclopropyl-3-(2,3,3-trimethylbutylamino)pyrazin-2-one
CID 83144354
1-cyclopropyl-3-(2-phenylpropylamino)pyrazin-2-one
CID 115917119
N-benzyl-1-cyclopropylimidazol-2-amine
CID 106555906
1-cyclopropyl-N-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine
CID 106579442
2-N-(1-cyclopropylimidazol-2-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 106566129

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine?
The IUPAC name of 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine (CID 106580964) is 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine?
The canonical SMILES for 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine is CSC(C)CNc1nccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine?
The InChIKey is FTLGTSHUPIEMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-8(14-2)7-12-10-11-5-6-13(10)9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3,(H,11,12).
What are the key properties of 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine?
1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine has a molecular weight of 211.33 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2-methylsulfanylpropyl)imidazol-2-amine is sourced from PubChem (CID 106580964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).