(3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol

C7H13N3O — CID 94420132

IUPAC(3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol
SMILESCn1cc([C@H](N)CCO)cn1
InChIInChI=1S/C7H13N3O/c1-10-5-6(4-9-10)7(8)2-3-11/h4-5,7,11H,2-3,8H2,1H3/t7-/m1/s1
InChIKeyBJAAQWWNIVGAON-SSDOTTSWSA-N
MW155.20 g/mol
LogP-0.20
Rot. Bonds3

About (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol

(3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol (PubChem CID 94420132) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name(3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol
PubChem CID94420132
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name(3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol
SMILESCn1cc([C@H](N)CCO)cn1
InChIInChI=1S/C7H13N3O/c1-10-5-6(4-9-10)7(8)2-3-11/h4-5,7,11H,2-3,8H2,1H3/t7-/m1/s1
InChIKeyBJAAQWWNIVGAON-SSDOTTSWSA-N
XLogP-0.20
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 93471722
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CID 93094324
(3R)-3-amino-3-(1-methylpyrazol-4-yl)propanoic acid
CID 28600208
3-amino-3-(1-prop-2-ynylpyrazol-4-yl)propan-1-ol
CID 84767896
1-(1-methylpyrazol-4-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103010531
1-(1-methylpyrazol-4-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103147973
3-amino-4-(1-methylpyrazol-4-yl)sulfanylbutan-1-ol
CID 64900094
3-(4-methoxyphenyl)-1-(1-methylpyrazol-4-yl)propan-1-amine
CID 43124177
1-(1-methylpyrazol-4-yl)-N',N'-dipropylethane-1,2-diamine
CID 115291096
3-[2-amino-1-(1-methylpyrazol-4-yl)propyl]sulfanylpropan-1-ol
CID 66115460
1-amino-1-(1-methylpyrazol-4-yl)butan-2-ol
CID 82412738
1-(1-methylpyrazol-4-yl)-2-pyridin-4-ylethanamine
CID 62551755

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol?
The IUPAC name of (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol (CID 94420132) is (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol.
What is the SMILES notation for (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol?
The canonical SMILES for (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol is Cn1cc([C@H](N)CCO)cn1.
What is the InChIKey of (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol?
The InChIKey is BJAAQWWNIVGAON-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H13N3O/c1-10-5-6(4-9-10)7(8)2-3-11/h4-5,7,11H,2-3,8H2,1H3/t7-/m1/s1.
What are the key properties of (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol?
(3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol has a molecular weight of 155.20 g/mol, XLogP of -0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol is sourced from PubChem (CID 94420132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).