4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine

C11H14N4O — CID 107541586

IUPAC4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine
SMILESCN(Cc1ccco1)c1nccc(CN)n1
InChIInChI=1S/C11H14N4O/c1-15(8-10-3-2-6-16-10)11-13-5-4-9(7-12)14-11/h2-6H,7-8,12H2,1H3
InChIKeyZIKPERLEQSOFQK-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.16
Rot. Bonds4

About 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine

4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine (PubChem CID 107541586) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine
PubChem CID107541586
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine
SMILESCN(Cc1ccco1)c1nccc(CN)n1
InChIInChI=1S/C11H14N4O/c1-15(8-10-3-2-6-16-10)11-13-5-4-9(7-12)14-11/h2-6H,7-8,12H2,1H3
InChIKeyZIKPERLEQSOFQK-UHFFFAOYSA-N
XLogP1.16
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine
CID 62301068
3-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylisoquinolin-1-amine
CID 62299114
4-(aminomethyl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-2-amine
CID 107541978
6-chloro-2-N-(furan-2-ylmethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 55125089
2-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylquinolin-4-amine
CID 63374307
N-(furan-2-ylmethyl)-N-methyl-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine
CID 46994739
2-N-(2-aminoethyl)-4-N-(furan-2-ylmethyl)-4-N-methylpyrimidine-2,4-diamine
CID 91018803
4-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrimidin-2-amine
CID 107541680
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
5-(ethylaminomethyl)-N-(furan-2-ylmethyl)-N,4-dimethylpyrimidin-2-amine
CID 83186463
N-(furan-2-ylmethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80906186

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine?
The IUPAC name of 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine (CID 107541586) is 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine is CN(Cc1ccco1)c1nccc(CN)n1.
What is the InChIKey of 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine?
The InChIKey is ZIKPERLEQSOFQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15(8-10-3-2-6-16-10)11-13-5-4-9(7-12)14-11/h2-6H,7-8,12H2,1H3.
What are the key properties of 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine?
4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine has a molecular weight of 218.26 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine is sourced from PubChem (CID 107541586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).