1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine

C10H17N3O — CID 79770820

IUPAC1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine
SMILESCn1cc(NCCC2CCCO2)cn1
InChIInChI=1S/C10H17N3O/c1-13-8-9(7-12-13)11-5-4-10-3-2-6-14-10/h7-8,10-11H,2-6H2,1H3
InChIKeyMOOCKCJDPONZTH-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.40
Rot. Bonds4

About 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine

1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine (PubChem CID 79770820) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine
PubChem CID79770820
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine
SMILESCn1cc(NCCC2CCCO2)cn1
InChIInChI=1S/C10H17N3O/c1-13-8-9(7-12-13)11-5-4-10-3-2-6-14-10/h7-8,10-11H,2-6H2,1H3
InChIKeyMOOCKCJDPONZTH-UHFFFAOYSA-N
XLogP1.40
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-N-[2-(oxolan-2-yl)ethyl]pyrazole-3,4-diamine
CID 103078320
3-N-methyl-5-N-[2-(oxolan-2-yl)ethyl]pyridine-3,5-diamine
CID 104533904
5-methyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-2-amine
CID 63208180
1-methyl-N-(2-pyrrolidin-2-ylethyl)pyrazol-4-amine
CID 103568889
1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-4-amine
CID 103568741
1-methyl-4-(oxolan-2-ylmethoxy)pyrazole
CID 116794075
N-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylaniline
CID 63182100
1-methyl-3-[2-(oxolan-2-yl)ethylamino]pyrazin-2-one
CID 62938870
1-(1-methylpyrazol-4-yl)-4-(oxolan-2-yl)-N-propylbutan-2-amine
CID 115821197
3-bromo-5-methyl-N-[2-(oxolan-2-yl)ethyl]aniline
CID 102975836
N,1-bis(oxolan-2-ylmethyl)pyrazol-4-amine
CID 82835947
N-[(1-methylpyrazol-4-yl)methyl]-1-[(2S)-oxolan-2-yl]methanamine
CID 42281898

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine (CID 79770820) is 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine is Cn1cc(NCCC2CCCO2)cn1.
What is the InChIKey of 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine?
The InChIKey is MOOCKCJDPONZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-8-9(7-12-13)11-5-4-10-3-2-6-14-10/h7-8,10-11H,2-6H2,1H3.
What are the key properties of 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine?
1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine has a molecular weight of 195.27 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 79770820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).