[1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol

C10H17N3O — CID 102547567

IUPAC[1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol
SMILESCn1nccc1C(O)C1(CN)CCC1
InChIInChI=1S/C10H17N3O/c1-13-8(3-6-12-13)9(14)10(7-11)4-2-5-10/h3,6,9,14H,2,4-5,7,11H2,1H3
InChIKeyNKWOBSCYRQEHIX-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.58
Rot. Bonds3

About [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol

[1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol (PubChem CID 102547567) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name[1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol
PubChem CID102547567
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name[1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol
SMILESCn1nccc1C(O)C1(CN)CCC1
InChIInChI=1S/C10H17N3O/c1-13-8(3-6-12-13)9(14)10(7-11)4-2-5-10/h3,6,9,14H,2,4-5,7,11H2,1H3
InChIKeyNKWOBSCYRQEHIX-UHFFFAOYSA-N
XLogP0.58
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(aminomethyl)-4-ethylcyclohexyl]-(2-methylpyrazol-3-yl)methanol
CID 114554625
1-[hydroxy-(2-methylpyrazol-3-yl)methyl]cycloheptan-1-ol
CID 103451942
[1-(dimethylamino)cyclopentyl]-(2-methylpyrazol-3-yl)methanol
CID 79068264
[1-(aminomethyl)cyclobutyl]-(1-methylpyrazol-4-yl)methanol
CID 79135001
3-amino-1-(2-methylpyrazol-3-yl)propan-1-ol
CID 82595670
(1-ethoxy-3-methylcyclohexyl)-(2-methylpyrazol-3-yl)methanol
CID 116755312
[1-(aminomethyl)cyclopentyl]-(4-methylphenyl)methanol
CID 79137754
[1-(2-methylpyrazol-3-yl)cyclobutyl]methanamine
CID 82596986
(1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanamine
CID 115858366
(1-methoxy-4,4-dimethylcyclohexyl)-(2-methylpyrazol-3-yl)methanol
CID 116755712
[1-(dimethylamino)-4-methylcyclohexyl]-(2-methylpyrazol-3-yl)methanol
CID 79074868
[4-(aminomethyl)oxan-4-yl]-(3-methylimidazol-4-yl)methanol
CID 79125466

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol?
The IUPAC name of [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol (CID 102547567) is [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol.
What is the SMILES notation for [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol?
The canonical SMILES for [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol is Cn1nccc1C(O)C1(CN)CCC1.
What is the InChIKey of [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol?
The InChIKey is NKWOBSCYRQEHIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-8(3-6-12-13)9(14)10(7-11)4-2-5-10/h3,6,9,14H,2,4-5,7,11H2,1H3.
What are the key properties of [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol?
[1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol has a molecular weight of 195.27 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclobutyl]-(2-methylpyrazol-3-yl)methanol is sourced from PubChem (CID 102547567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).