4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine

C10H14N4O — CID 82237096

IUPAC4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine
SMILESCc1nc(N(C)Cc2ccco2)c(N)[nH]1
InChIInChI=1S/C10H14N4O/c1-7-12-9(11)10(13-7)14(2)6-8-4-3-5-15-8/h3-5H,6,11H2,1-2H3,(H,12,13)
InChIKeyWRYSYLJYNWIXQY-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.53
Rot. Bonds3

About 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine

4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine (PubChem CID 82237096) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine.

Molecular Properties

Compound Name4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine
PubChem CID82237096
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine
SMILESCc1nc(N(C)Cc2ccco2)c(N)[nH]1
InChIInChI=1S/C10H14N4O/c1-7-12-9(11)10(13-7)14(2)6-8-4-3-5-15-8/h3-5H,6,11H2,1-2H3,(H,12,13)
InChIKeyWRYSYLJYNWIXQY-UHFFFAOYSA-N
XLogP1.53
TPSA71.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine
CID 79828230
3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine
CID 61176681
N-(furan-2-ylmethyl)-5-iodo-N-methylpyrimidin-4-amine
CID 65418233
3-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylisoquinolin-1-amine
CID 62299114
N-(furan-2-ylmethyl)-2-hydrazinyl-N,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 103332276
4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine
CID 107541586
N-(furan-2-ylmethyl)-N,6-dimethyl-2-morpholin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 91961095
6-ethyl-4-N-(furan-2-ylmethyl)-4-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324904
[2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol
CID 61255618
1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine;hydrochloride
CID 3028206
2-N-ethyl-4-N-(furan-2-ylmethyl)-4-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324905
6-N-(furan-2-ylmethyl)-2-N,6-N-dimethyl-7H-purine-2,6-diamine
CID 114783888

Frequently Asked Questions

What is the IUPAC name of 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine?
The IUPAC name of 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine (CID 82237096) is 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine.
What is the SMILES notation for 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine?
The canonical SMILES for 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine is Cc1nc(N(C)Cc2ccco2)c(N)[nH]1.
What is the InChIKey of 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine?
The InChIKey is WRYSYLJYNWIXQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-7-12-9(11)10(13-7)14(2)6-8-4-3-5-15-8/h3-5H,6,11H2,1-2H3,(H,12,13).
What are the key properties of 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine?
4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine has a molecular weight of 206.25 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine is sourced from PubChem (CID 82237096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).