1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine

C14H26N4 — CID 43534727

IUPAC1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine
SMILESCCCN1CCCC(C(C)Nc2cnn(C)c2)C1
InChIInChI=1S/C14H26N4/c1-4-7-18-8-5-6-13(10-18)12(2)16-14-9-15-17(3)11-14/h9,11-13,16H,4-8,10H2,1-3H3
InChIKeyANVYUZDVJZLMNZ-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.34
Rot. Bonds5

About 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine

1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine (PubChem CID 43534727) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine
PubChem CID43534727
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine
SMILESCCCN1CCCC(C(C)Nc2cnn(C)c2)C1
InChIInChI=1S/C14H26N4/c1-4-7-18-8-5-6-13(10-18)12(2)16-14-9-15-17(3)11-14/h9,11-13,16H,4-8,10H2,1-3H3
InChIKeyANVYUZDVJZLMNZ-UHFFFAOYSA-N
XLogP2.34
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine (CID 43534727) is 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine is CCCN1CCCC(C(C)Nc2cnn(C)c2)C1.
What is the InChIKey of 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine?
The InChIKey is ANVYUZDVJZLMNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-4-7-18-8-5-6-13(10-18)12(2)16-14-9-15-17(3)11-14/h9,11-13,16H,4-8,10H2,1-3H3.
What are the key properties of 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine?
1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine has a molecular weight of 250.39 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 43534727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).