4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine

C9H16N4 — CID 106554004

IUPAC4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine
SMILESCc1cnc(N2CC(C)C(N)C2)[nH]1
InChIInChI=1S/C9H16N4/c1-6-4-13(5-8(6)10)9-11-3-7(2)12-9/h3,6,8H,4-5,10H2,1-2H3,(H,11,12)
InChIKeyPWEVNSGIWPDGIV-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.50
Rot. Bonds1

About 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine

4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine (PubChem CID 106554004) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine
PubChem CID106554004
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC Name4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine
SMILESCc1cnc(N2CC(C)C(N)C2)[nH]1
InChIInChI=1S/C9H16N4/c1-6-4-13(5-8(6)10)9-11-3-7(2)12-9/h3,6,8H,4-5,10H2,1-2H3,(H,11,12)
InChIKeyPWEVNSGIWPDGIV-UHFFFAOYSA-N
XLogP0.50
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-yl]ethanamine
CID 106553653
1-[4-(5-methyl-1H-imidazol-2-yl)morpholin-2-yl]ethanamine
CID 106553336
4-(3-amino-4-methylpyrrolidin-1-yl)-2-methyl-1H-pyrimidin-6-one
CID 136677207
4-(fluoromethyl)-1-(5-methyl-1H-imidazol-2-yl)piperidine
CID 164659448
4-methyl-1-(3-methyl-4-pyridinyl)pyrrolidin-3-amine
CID 103577369
4-methyl-1-(6-methylsulfanylpyrimidin-4-yl)pyrrolidin-3-amine
CID 106973347
N-methyl-1-[1-(5-methyl-1H-imidazol-2-yl)piperidin-4-yl]methanamine
CID 106552662
4-methyl-1-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine
CID 103577705
4-methyl-1-(5-methyl-3-nitro-2-pyridinyl)pyrrolidin-3-amine
CID 103577513
1-(3-fluoro-2-pyridinyl)-4-methylpyrrolidin-3-amine
CID 103577365
4-methyl-1-(1-propan-2-ylimidazol-2-yl)pyrrolidin-3-amine
CID 106554002
4-methyl-1-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]pyrrolidin-3-amine
CID 103576385

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine?
The IUPAC name of 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine (CID 106554004) is 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine?
The canonical SMILES for 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine is Cc1cnc(N2CC(C)C(N)C2)[nH]1.
What is the InChIKey of 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine?
The InChIKey is PWEVNSGIWPDGIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-6-4-13(5-8(6)10)9-11-3-7(2)12-9/h3,6,8H,4-5,10H2,1-2H3,(H,11,12).
What are the key properties of 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine?
4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine has a molecular weight of 180.25 g/mol, XLogP of 0.50, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(5-methyl-1H-imidazol-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 106554004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).