N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine

C12H22N4 — CID 83007579

IUPACN-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine
SMILESCCCn1cncc1CNN1CCCCC1
InChIInChI=1S/C12H22N4/c1-2-6-15-11-13-9-12(15)10-14-16-7-4-3-5-8-16/h9,11,14H,2-8,10H2,1H3
InChIKeyVLTWIMPSVIUJGH-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.78
Rot. Bonds5

About N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine

N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine (PubChem CID 83007579) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine
PubChem CID83007579
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine
SMILESCCCn1cncc1CNN1CCCCC1
InChIInChI=1S/C12H22N4/c1-2-6-15-11-13-9-12(15)10-14-16-7-4-3-5-8-16/h9,11,14H,2-8,10H2,1H3
InChIKeyVLTWIMPSVIUJGH-UHFFFAOYSA-N
XLogP1.78
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-ethylimidazol-4-yl)methyl]morpholin-4-amine
CID 83008990
1-piperidin-1-yl-2-[(3-propylimidazol-4-yl)methylamino]propan-1-one
CID 66130168
2-methyl-N-[(3-propylimidazol-4-yl)methyl]cycloheptan-1-amine
CID 66129396
N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine
CID 114556039
N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine
CID 66152169
N,N-dimethyl-1-[[(3-propylimidazol-4-yl)methylamino]methyl]cyclohexan-1-amine
CID 66133760
1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine
CID 66134778
N-[(1-methylcyclopentyl)methyl]-1-(3-propylimidazol-4-yl)methanamine
CID 66129391
1-methyl-N-[(3-propylimidazol-4-yl)methyl]pyrazol-4-amine
CID 66135408
N-[(3-propylimidazol-4-yl)methyl]but-3-yn-1-amine
CID 66130391
1-(4-ethylphenyl)-N-[(3-propylimidazol-4-yl)methyl]methanamine
CID 106899534
3-[(3-propylimidazol-4-yl)methylamino]cyclobutan-1-ol
CID 66129997

Frequently Asked Questions

What is the IUPAC name of N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine?
The IUPAC name of N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine (CID 83007579) is N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine.
What is the SMILES notation for N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine?
The canonical SMILES for N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine is CCCn1cncc1CNN1CCCCC1.
What is the InChIKey of N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine?
The InChIKey is VLTWIMPSVIUJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-2-6-15-11-13-9-12(15)10-14-16-7-4-3-5-8-16/h9,11,14H,2-8,10H2,1H3.
What are the key properties of N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine?
N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine has a molecular weight of 222.34 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-propylimidazol-4-yl)methyl]piperidin-1-amine is sourced from PubChem (CID 83007579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).