1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine

C12H24N4 — CID 115034739

IUPAC1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine
SMILESCC(C)N1CCN=C1NCCC1CCNC1
InChIInChI=1S/C12H24N4/c1-10(2)16-8-7-15-12(16)14-6-4-11-3-5-13-9-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyVRIWULKWSPBCPJ-UHFFFAOYSA-N
MW224.35 g/mol
LogP0.66
Rot. Bonds4

About 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine

1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine (PubChem CID 115034739) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine
PubChem CID115034739
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC Name1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine
SMILESCC(C)N1CCN=C1NCCC1CCNC1
InChIInChI=1S/C12H24N4/c1-10(2)16-8-7-15-12(16)14-6-4-11-3-5-13-9-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyVRIWULKWSPBCPJ-UHFFFAOYSA-N
XLogP0.66
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-(2-pyrrolidin-3-ylethyl)tetrazol-5-amine
CID 63623261
N-(2-pyrrolidin-3-ylethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114401742
2-fluoro-4-(1-fluoroethyl)-N-(2-pyrrolidin-3-ylethyl)aniline
CID 115054195
N-[2-[(3S)-pyrrolidin-3-yl]ethyl]propan-2-amine;hydrochloride
CID 71637413
2-bromo-4-(1-fluoroethyl)-N-(2-pyrrolidin-3-ylethyl)aniline
CID 115054197
1-tert-butyl-N-(2-pyrrolidin-3-ylethyl)imidazol-2-amine
CID 115041761
2-methyl-N-(2-pyrrolidin-3-ylethyl)pyrazol-3-amine
CID 103542541
4-(1-fluoroethyl)-N-(2-pyrrolidin-3-ylethyl)-2-(trifluoromethyl)aniline
CID 115053478
1-methyl-N-(2-pyrrolidin-3-ylethyl)-4,5,6,7-tetrahydrobenzimidazol-2-amine
CID 115055130
3-ethyl-N-(2-pyrrolidin-3-ylethyl)-1,2,4-thiadiazol-5-amine
CID 65276112
N-(2-pyrrolidin-3-ylethyl)propane-2-sulfonamide
CID 63624529
4-methyl-N-(2-pyrrolidin-3-ylethyl)pentan-1-amine
CID 115210839

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine (CID 115034739) is 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine is CC(C)N1CCN=C1NCCC1CCNC1.
What is the InChIKey of 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is VRIWULKWSPBCPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4/c1-10(2)16-8-7-15-12(16)14-6-4-11-3-5-13-9-11/h10-11,13H,3-9H2,1-2H3,(H,14,15).
What are the key properties of 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine?
1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 224.35 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-N-(2-pyrrolidin-3-ylethyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 115034739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).