N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine

C12H22N4 — CID 106568397

IUPACN-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine
SMILESCCCN1CCC(n2ccnc2NC)CC1
InChIInChI=1S/C12H22N4/c1-3-7-15-8-4-11(5-9-15)16-10-6-14-12(16)13-2/h6,10-11H,3-5,7-9H2,1-2H3,(H,13,14)
InChIKeyXNHIDEKIPMQVOH-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.97
Rot. Bonds4

About N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine

N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine (PubChem CID 106568397) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine
PubChem CID106568397
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine
SMILESCCCN1CCC(n2ccnc2NC)CC1
InChIInChI=1S/C12H22N4/c1-3-7-15-8-4-11(5-9-15)16-10-6-14-12(16)13-2/h6,10-11H,3-5,7-9H2,1-2H3,(H,13,14)
InChIKeyXNHIDEKIPMQVOH-UHFFFAOYSA-N
XLogP1.97
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
The IUPAC name of N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine (CID 106568397) is N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine.
What is the SMILES notation for N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
The canonical SMILES for N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine is CCCN1CCC(n2ccnc2NC)CC1.
What is the InChIKey of N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
The InChIKey is XNHIDEKIPMQVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-3-7-15-8-4-11(5-9-15)16-10-6-14-12(16)13-2/h6,10-11H,3-5,7-9H2,1-2H3,(H,13,14).
What are the key properties of N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine has a molecular weight of 222.34 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine is sourced from PubChem (CID 106568397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).