N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine

C12H22N4 — CID 114556039

IUPACN-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine
SMILESCCCn1nccc1CNN1CCCCC1
InChIInChI=1S/C12H22N4/c1-2-8-16-12(6-7-13-16)11-14-15-9-4-3-5-10-15/h6-7,14H,2-5,8-11H2,1H3
InChIKeyLZVFVQFLWPSPNU-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.78
Rot. Bonds5

About N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine

N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine (PubChem CID 114556039) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine
PubChem CID114556039
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine
SMILESCCCn1nccc1CNN1CCCCC1
InChIInChI=1S/C12H22N4/c1-2-8-16-12(6-7-13-16)11-14-15-9-4-3-5-10-15/h6-7,14H,2-5,8-11H2,1H3
InChIKeyLZVFVQFLWPSPNU-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-[(2-propylpyrazol-3-yl)methyl]hydroxylamine
CID 114556004
1-(2-ethylpyrazol-3-yl)-N-[(2-propylpyrazol-3-yl)methyl]methanamine
CID 19625523
1-methyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine
CID 114555624
N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylaniline
CID 114555092
N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 114555031
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1-(2-propylpyrazol-3-yl)methanamine
CID 107163325
N-[[2-(2-fluoroethyl)pyrazol-3-yl]methyl]-1-(2-propylpyrazol-3-yl)methanamine
CID 122166952
1-(1-ethylpyrrolidin-2-yl)-N-[(2-propylpyrazol-3-yl)methyl]methanamine
CID 114554795
4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114555631
2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine
CID 114556145
4-fluoro-N-[(2-propylpyrazol-3-yl)methyl]aniline
CID 19626118
2-methyl-N-[(2-propylpyrazol-3-yl)methyl]prop-2-en-1-amine
CID 114615846

Frequently Asked Questions

What is the IUPAC name of N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine?
The IUPAC name of N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine (CID 114556039) is N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine.
What is the SMILES notation for N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine?
The canonical SMILES for N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine is CCCn1nccc1CNN1CCCCC1.
What is the InChIKey of N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine?
The InChIKey is LZVFVQFLWPSPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-2-8-16-12(6-7-13-16)11-14-15-9-4-3-5-10-15/h6-7,14H,2-5,8-11H2,1H3.
What are the key properties of N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine?
N-[(2-propylpyrazol-3-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-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine is sourced from PubChem (CID 114556039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).