N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine

C10H19N3O — CID 116805301

IUPACN,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine
SMILESCC(C)n1cc(OCCN(C)C)cn1
InChIInChI=1S/C10H19N3O/c1-9(2)13-8-10(7-11-13)14-6-5-12(3)4/h7-9H,5-6H2,1-4H3
InChIKeySUIZHNXVFCQFIQ-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.40
Rot. Bonds5

About N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine

N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine (PubChem CID 116805301) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine
PubChem CID116805301
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC NameN,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine
SMILESCC(C)n1cc(OCCN(C)C)cn1
InChIInChI=1S/C10H19N3O/c1-9(2)13-8-10(7-11-13)14-6-5-12(3)4/h7-9H,5-6H2,1-4H3
InChIKeySUIZHNXVFCQFIQ-UHFFFAOYSA-N
XLogP1.40
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine?
The IUPAC name of N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine (CID 116805301) is N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine.
What is the SMILES notation for N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine?
The canonical SMILES for N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine is CC(C)n1cc(OCCN(C)C)cn1.
What is the InChIKey of N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine?
The InChIKey is SUIZHNXVFCQFIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-9(2)13-8-10(7-11-13)14-6-5-12(3)4/h7-9H,5-6H2,1-4H3.
What are the key properties of N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine?
N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine has a molecular weight of 197.28 g/mol, XLogP of 1.40, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1-propan-2-ylpyrazol-4-yl)oxyethanamine is sourced from PubChem (CID 116805301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).