1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol

C14H26N4O — CID 62991007

IUPAC1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol
SMILESCC(CNCC(O)Cn1cccn1)CN1CCCC1
InChIInChI=1S/C14H26N4O/c1-13(11-17-6-2-3-7-17)9-15-10-14(19)12-18-8-4-5-16-18/h4-5,8,13-15,19H,2-3,6-7,9-12H2,1H3
InChIKeyNCHWIAPBMZSUNH-UHFFFAOYSA-N
MW266.39 g/mol
LogP0.57
Rot. Bonds8

About 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol

1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol (PubChem CID 62991007) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol
PubChem CID62991007
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol
SMILESCC(CNCC(O)Cn1cccn1)CN1CCCC1
InChIInChI=1S/C14H26N4O/c1-13(11-17-6-2-3-7-17)9-15-10-14(19)12-18-8-4-5-16-18/h4-5,8,13-15,19H,2-3,6-7,9-12H2,1H3
InChIKeyNCHWIAPBMZSUNH-UHFFFAOYSA-N
XLogP0.57
TPSA53.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methylpropylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60904302
1-(2-methylbutylamino)-3-pyrrolidin-1-ylpropan-2-ol
CID 62692013
1-(3-methylbutylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60897907
(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol
CID 106932098
N-ethyl-2-[(2-hydroxy-3-pyrazol-1-ylpropyl)amino]acetamide
CID 60910442
1-[(1-methylpyrrolidin-2-yl)methylamino]-3-pyrazol-1-ylpropan-2-ol
CID 114138299
4-[(2-hydroxy-3-pyrrolidin-1-ylpropyl)amino]-3-methylbutan-1-ol
CID 66106831
1-[3-(2-methylpiperidin-1-yl)propylamino]-3-pyrazol-1-ylpropan-2-ol
CID 60898299
2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine
CID 62448113
1-(1,4-diazepan-1-yl)-3-pyrazol-1-ylpropan-2-ol
CID 102538343
1-[(4-methylpiperazin-1-yl)amino]-3-pyrazol-1-ylpropan-2-ol
CID 83021560
1-[(4-ethylmorpholin-2-yl)methylamino]-3-pyrazol-1-ylpropan-2-ol
CID 115626302

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol?
The IUPAC name of 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol (CID 62991007) is 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol.
What is the SMILES notation for 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol?
The canonical SMILES for 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol is CC(CNCC(O)Cn1cccn1)CN1CCCC1.
What is the InChIKey of 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol?
The InChIKey is NCHWIAPBMZSUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-13(11-17-6-2-3-7-17)9-15-10-14(19)12-18-8-4-5-16-18/h4-5,8,13-15,19H,2-3,6-7,9-12H2,1H3.
What are the key properties of 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol?
1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol has a molecular weight of 266.39 g/mol, XLogP of 0.57, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol is sourced from PubChem (CID 62991007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).