N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine

C14H26N4O — CID 71868941

IUPACN-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine
SMILESCC(C)c1cc(N(C)CCCN2CCOCC2)n[nH]1
InChIInChI=1S/C14H26N4O/c1-12(2)13-11-14(16-15-13)17(3)5-4-6-18-7-9-19-10-8-18/h11-12H,4-10H2,1-3H3,(H,15,16)
InChIKeyAANFHPBXZDBHQI-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.69
Rot. Bonds6

About N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine

N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine (PubChem CID 71868941) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound NameN-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine
PubChem CID71868941
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine
SMILESCC(C)c1cc(N(C)CCCN2CCOCC2)n[nH]1
InChIInChI=1S/C14H26N4O/c1-12(2)13-11-14(16-15-13)17(3)5-4-6-18-7-9-19-10-8-18/h11-12H,4-10H2,1-3H3,(H,15,16)
InChIKeyAANFHPBXZDBHQI-UHFFFAOYSA-N
XLogP1.69
TPSA44.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine?
The IUPAC name of N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine (CID 71868941) is N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine.
What is the SMILES notation for N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine?
The canonical SMILES for N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine is CC(C)c1cc(N(C)CCCN2CCOCC2)n[nH]1.
What is the InChIKey of N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine?
The InChIKey is AANFHPBXZDBHQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-12(2)13-11-14(16-15-13)17(3)5-4-6-18-7-9-19-10-8-18/h11-12H,4-10H2,1-3H3,(H,15,16).
What are the key properties of N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine?
N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine has a molecular weight of 266.39 g/mol, XLogP of 1.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 71868941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).