[5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol

C14H24N4O — CID 61445720

IUPAC[5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol
SMILESCc1nn(C)c(N2CCN(CC3CC3)CC2)c1CO
InChIInChI=1S/C14H24N4O/c1-11-13(10-19)14(16(2)15-11)18-7-5-17(6-8-18)9-12-3-4-12/h12,19H,3-10H2,1-2H3
InChIKeyFTWVFJDAPSWOAC-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.75
Rot. Bonds4

About [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol

[5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol (PubChem CID 61445720) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol
PubChem CID61445720
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name[5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol
SMILESCc1nn(C)c(N2CCN(CC3CC3)CC2)c1CO
InChIInChI=1S/C14H24N4O/c1-11-13(10-19)14(16(2)15-11)18-7-5-17(6-8-18)9-12-3-4-12/h12,19H,3-10H2,1-2H3
InChIKeyFTWVFJDAPSWOAC-UHFFFAOYSA-N
XLogP0.75
TPSA44.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol?
The IUPAC name of [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol (CID 61445720) is [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol.
What is the SMILES notation for [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol?
The canonical SMILES for [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol is Cc1nn(C)c(N2CCN(CC3CC3)CC2)c1CO.
What is the InChIKey of [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol?
The InChIKey is FTWVFJDAPSWOAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-11-13(10-19)14(16(2)15-11)18-7-5-17(6-8-18)9-12-3-4-12/h12,19H,3-10H2,1-2H3.
What are the key properties of [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol?
[5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol is sourced from PubChem (CID 61445720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).