N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine

C10H17N3 — CID 63048865

IUPACN-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine
SMILESCC(C)(C)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C10H17N3/c1-10(2,3)11-9-6-8(12-13-9)7-4-5-7/h6-7H,4-5H2,1-3H3,(H2,11,12,13)
InChIKeySTSYAKHOXDPROT-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.50
Rot. Bonds2

About N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine

N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine (PubChem CID 63048865) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine.

Molecular Properties

Compound NameN-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine
PubChem CID63048865
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine
SMILESCC(C)(C)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C10H17N3/c1-10(2,3)11-9-6-8(12-13-9)7-4-5-7/h6-7H,4-5H2,1-3H3,(H2,11,12,13)
InChIKeySTSYAKHOXDPROT-UHFFFAOYSA-N
XLogP2.50
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-cyclobutyl-1H-pyrazol-3-yl)propan-2-amine
CID 83846445
2-chloro-N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-ethylpyrimidin-4-amine
CID 86047710
6-N-(5-cyclopropyl-1H-pyrazol-3-yl)-4-N-[1-[4-(trifluoromethyl)phenyl]ethyl]pyrimidine-4,6-diamine
CID 155196380
2-N-[4-(2-aminopropan-2-yl)phenyl]-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
CID 71058238
N-(5-cyclohexyl-1H-pyrazol-3-yl)-2-(4-hydroxycyclohexyl)-2-methylpropanamide
CID 128766710
N-[3,5-bis(trifluoromethyl)phenyl]-5-cyclobutyl-1H-pyrazol-3-amine
CID 10154812
4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(1S)-1-(4-fluorophenyl)ethyl]pyridine-2,4,5-triamine
CID 67478872
2-N-(5-cyclopropyl-1H-pyrazol-3-yl)-4-N-[(1S)-1-(4-fluorophenyl)ethyl]benzene-1,2,4-triamine
CID 67478851
2-[[6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-[1-(4-fluorophenyl)ethylamino]pyrimidin-4-yl]amino]ethanol
CID 69234321
N-tert-butyl-5-[6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-methyl-2-pyridinyl]thiophene-2-sulfonamide
CID 58169181
5-chloro-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 68602988
CID 88969890
CID 88969890

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine?
The IUPAC name of N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine (CID 63048865) is N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine.
What is the SMILES notation for N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine?
The canonical SMILES for N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine is CC(C)(C)Nc1cc(C2CC2)[nH]n1.
What is the InChIKey of N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine?
The InChIKey is STSYAKHOXDPROT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-10(2,3)11-9-6-8(12-13-9)7-4-5-7/h6-7H,4-5H2,1-3H3,(H2,11,12,13).
What are the key properties of N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine?
N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine has a molecular weight of 179.27 g/mol, XLogP of 2.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-5-cyclopropyl-1H-pyrazol-3-amine is sourced from PubChem (CID 63048865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).