4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol

C11H21N3O — CID 115972661

IUPAC4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol
SMILESCc1cnn(CCNC(C)CCCO)c1
InChIInChI=1S/C11H21N3O/c1-10-8-13-14(9-10)6-5-12-11(2)4-3-7-15/h8-9,11-12,15H,3-7H2,1-2H3
InChIKeyKTLUZUXBWJGQPN-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.94
Rot. Bonds7

About 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol

4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol (PubChem CID 115972661) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol.

Molecular Properties

Compound Name4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol
PubChem CID115972661
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol
SMILESCc1cnn(CCNC(C)CCCO)c1
InChIInChI=1S/C11H21N3O/c1-10-8-13-14(9-10)6-5-12-11(2)4-3-7-15/h8-9,11-12,15H,3-7H2,1-2H3
InChIKeyKTLUZUXBWJGQPN-UHFFFAOYSA-N
XLogP0.94
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-[2-(4-methylpyrazol-1-yl)ethylamino]butyl]phenol
CID 104861935
(2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-4-phenylbutan-2-amine
CID 95607721
6-[2-(4-methylpyrazol-1-yl)ethylamino]hexan-1-ol
CID 103737929
4-(3-methylphenyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]butan-2-amine
CID 103871923
4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol
CID 103947686
2-[2-(4-methylpyrazol-1-yl)ethylamino]-N-propan-2-ylpropanamide
CID 113232733
1-(1-methylcyclopropyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]ethanamine
CID 115867879
1-(2,5-dimethylfuran-3-yl)-N-[2-(4-methylpyrazol-1-yl)ethyl]ethanamine
CID 113429021
(2S)-1-(4-methylpyrazol-1-yl)-N-[2-(1,2,4-triazol-1-yl)ethyl]propan-2-amine
CID 95298841
2-chloro-N-[2-(4-methylpyrazol-1-yl)ethyl]propanamide
CID 103881624
(1S)-1-(4-bromophenyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]ethanamine
CID 97073564
N-tert-butyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]propanamide
CID 113232712

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol?
The IUPAC name of 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol (CID 115972661) is 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol.
What is the SMILES notation for 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol?
The canonical SMILES for 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol is Cc1cnn(CCNC(C)CCCO)c1.
What is the InChIKey of 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol?
The InChIKey is KTLUZUXBWJGQPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-10-8-13-14(9-10)6-5-12-11(2)4-3-7-15/h8-9,11-12,15H,3-7H2,1-2H3.
What are the key properties of 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol?
4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol has a molecular weight of 211.31 g/mol, XLogP of 0.94, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol is sourced from PubChem (CID 115972661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).