5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine

C10H18N4 — CID 117038791

IUPAC5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine
SMILESCN(Cc1cc(N)n[nH]1)CC1CCC1
InChIInChI=1S/C10H18N4/c1-14(6-8-3-2-4-8)7-9-5-10(11)13-12-9/h5,8H,2-4,6-7H2,1H3,(H3,11,12,13)
InChIKeyOBJTUOSGKRRYDN-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.22
Rot. Bonds4

About 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine

5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine (PubChem CID 117038791) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine
PubChem CID117038791
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine
SMILESCN(Cc1cc(N)n[nH]1)CC1CCC1
InChIInChI=1S/C10H18N4/c1-14(6-8-3-2-4-8)7-9-5-10(11)13-12-9/h5,8H,2-4,6-7H2,1H3,(H3,11,12,13)
InChIKeyOBJTUOSGKRRYDN-UHFFFAOYSA-N
XLogP1.22
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-amino-1H-pyrazol-5-yl)methyl]-N,1-dimethylpiperidin-3-amine
CID 117038718
5-(cycloheptylmethyl)-1H-pyrazol-3-amine
CID 114458019
4-[[cyclobutylmethyl(methyl)amino]methyl]pyridin-2-amine
CID 62861916
5-[[methyl(propan-2-yl)amino]methyl]-1H-pyrazol-3-amine
CID 117038615
N-methyl-1-(oxan-3-yl)-N-[(3-propyl-1H-pyrazol-5-yl)methyl]methanamine
CID 91842915
5-[[(4-fluoro-3-methylphenyl)methyl-methylamino]methyl]-1H-pyrazol-3-amine
CID 117038736
5-[(1-ethylpiperidin-3-yl)methyl]-1H-pyrazol-3-amine
CID 115092847
2-bromo-5-[[cyclobutylmethyl(methyl)amino]methyl]aniline
CID 115557165
2-[[cyclopentylmethyl(methyl)amino]methyl]pyridin-4-amine
CID 79251445
3-[[cyclobutylmethyl(methyl)amino]methyl]-4-methoxyaniline
CID 62861974
5-[(propan-2-ylamino)methyl]-1H-pyrazol-3-amine
CID 117215911
1-cyclobutyl-N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 62861548

Frequently Asked Questions

What is the IUPAC name of 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine?
The IUPAC name of 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine (CID 117038791) is 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine.
What is the SMILES notation for 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine?
The canonical SMILES for 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine is CN(Cc1cc(N)n[nH]1)CC1CCC1.
What is the InChIKey of 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine?
The InChIKey is OBJTUOSGKRRYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-14(6-8-3-2-4-8)7-9-5-10(11)13-12-9/h5,8H,2-4,6-7H2,1H3,(H3,11,12,13).
What are the key properties of 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine?
5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine has a molecular weight of 194.28 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[cyclobutylmethyl(methyl)amino]methyl]-1H-pyrazol-3-amine is sourced from PubChem (CID 117038791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).