1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine

C10H18N4 — CID 106565238

IUPAC1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
SMILESCN1CCCCC1Cn1ccnc1N
InChIInChI=1S/C10H18N4/c1-13-6-3-2-4-9(13)8-14-7-5-12-10(14)11/h5,7,9H,2-4,6,8H2,1H3,(H2,11,12)
InChIKeyJWLRQYZNGNGVEC-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.95
Rot. Bonds2

About 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine

1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine (PubChem CID 106565238) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
PubChem CID106565238
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
SMILESCN1CCCCC1Cn1ccnc1N
InChIInChI=1S/C10H18N4/c1-13-6-3-2-4-9(13)8-14-7-5-12-10(14)11/h5,7,9H,2-4,6,8H2,1H3,(H2,11,12)
InChIKeyJWLRQYZNGNGVEC-UHFFFAOYSA-N
XLogP0.95
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
The IUPAC name of 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine (CID 106565238) is 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
The canonical SMILES for 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine is CN1CCCCC1Cn1ccnc1N.
What is the InChIKey of 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
The InChIKey is JWLRQYZNGNGVEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-13-6-3-2-4-9(13)8-14-7-5-12-10(14)11/h5,7,9H,2-4,6,8H2,1H3,(H2,11,12).
What are the key properties of 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine?
1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine has a molecular weight of 194.28 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106565238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).