N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine

C16H29N5 — CID 64784047

IUPACN-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine
SMILESCN(CCN1CCNCC1)Cc1ccn(C2CCCC2)n1
InChIInChI=1S/C16H29N5/c1-19(12-13-20-10-7-17-8-11-20)14-15-6-9-21(18-15)16-4-2-3-5-16/h6,9,16-17H,2-5,7-8,10-14H2,1H3
InChIKeyZZAQTFKZCWJZJT-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.34
Rot. Bonds6

About N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine

N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine (PubChem CID 64784047) has the molecular formula C16H29N5 and a molecular weight of 291.44 g/mol. Its IUPAC name is N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine.

Molecular Properties

Compound NameN-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine
PubChem CID64784047
Molecular FormulaC16H29N5
Molecular Weight291.44 g/mol
Exact Mass291.24
IUPAC NameN-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine
SMILESCN(CCN1CCNCC1)Cc1ccn(C2CCCC2)n1
InChIInChI=1S/C16H29N5/c1-19(12-13-20-10-7-17-8-11-20)14-15-6-9-21(18-15)16-4-2-3-5-16/h6,9,16-17H,2-5,7-8,10-14H2,1H3
InChIKeyZZAQTFKZCWJZJT-UHFFFAOYSA-N
XLogP1.34
TPSA36.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(1-cyclopentylpyrazol-3-yl)methyl-methylamino]propanoic acid
CID 64785385
4-[(1-cyclopentylpyrazol-3-yl)methyl-methylamino]butan-2-ol
CID 113259203
5-bromo-N-[(1-cyclohexylpyrazol-3-yl)methyl]-N-methylpentan-1-amine
CID 107204922
N-methyl-2-piperazin-1-yl-N-(pyridin-2-ylmethyl)ethanamine
CID 54945083
N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-ethylpyrrolidin-3-amine
CID 64784435
1-[(1-cyclopentylpyrazol-3-yl)methyl]-3-methylpiperazine
CID 64833588
N-[(6-methoxy-2-pyridinyl)methyl]-N-methyl-2-piperazin-1-ylethanamine
CID 63986317
(3R)-1-[(1-cyclohexylpyrazol-3-yl)methyl]-3-methylpiperazine
CID 104975598
N-cyclopropyl-N-[(1-cyclopropylpyrazol-3-yl)methyl]piperidin-4-amine
CID 166313694
1-cyclohexyl-3-ethylpyrazole
CID 66014335
N'-[(1-cyclopentylpyrazol-3-yl)methyl]-N'-propan-2-ylethane-1,2-diamine
CID 64800221
N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-(piperidin-2-ylmethyl)ethanamine
CID 106632392

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine?
The IUPAC name of N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine (CID 64784047) is N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine.
What is the SMILES notation for N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine?
The canonical SMILES for N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine is CN(CCN1CCNCC1)Cc1ccn(C2CCCC2)n1.
What is the InChIKey of N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine?
The InChIKey is ZZAQTFKZCWJZJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N5/c1-19(12-13-20-10-7-17-8-11-20)14-15-6-9-21(18-15)16-4-2-3-5-16/h6,9,16-17H,2-5,7-8,10-14H2,1H3.
What are the key properties of N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine?
N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine has a molecular weight of 291.44 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine is sourced from PubChem (CID 64784047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).