N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine

C16H25N5 — CID 122167995

IUPACN-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine
SMILESCCn1ncc(NCc2cc(C3CC3)nn2C(C)C)c1C
InChIInChI=1S/C16H25N5/c1-5-20-12(4)16(10-18-20)17-9-14-8-15(13-6-7-13)19-21(14)11(2)3/h8,10-11,13,17H,5-7,9H2,1-4H3
InChIKeyFLEZFBOLLQIIBX-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.48
Rot. Bonds6

About N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine

N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine (PubChem CID 122167995) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine.

Molecular Properties

Compound NameN-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine
PubChem CID122167995
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC NameN-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine
SMILESCCn1ncc(NCc2cc(C3CC3)nn2C(C)C)c1C
InChIInChI=1S/C16H25N5/c1-5-20-12(4)16(10-18-20)17-9-14-8-15(13-6-7-13)19-21(14)11(2)3/h8,10-11,13,17H,5-7,9H2,1-4H3
InChIKeyFLEZFBOLLQIIBX-UHFFFAOYSA-N
XLogP3.48
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]propan-1-amine
CID 122166419
N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]hexan-1-amine
CID 122166428
2-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methylamino]ethanol;hydrochloride
CID 126966695
1-ethyl-N-[(1-ethyl-4-methylpyrazol-5-yl)methyl]-5-methylpyrazol-4-amine
CID 122167136
N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-3-methoxypropan-1-amine
CID 122166425
3-cyclopropyl-5-methyl-1-propan-2-ylpyrazole
CID 122521943
N-benzyl-1-ethyl-5-methylpyrazol-4-amine;hydrochloride
CID 126964810
1-ethyl-5-methyl-N-[(2-propylpyrazol-3-yl)methyl]pyrazol-4-amine
CID 122166967
N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-3-morpholin-4-ylpropan-1-amine;dihydrochloride
CID 126967056
3-cyclopropyl-5-iodo-1-propan-2-ylpyrazole
CID 139331075
3-[[(1-ethyl-5-methylpyrazol-4-yl)amino]methyl]phenol
CID 122168784
N-[(2,5-difluorophenyl)methyl]-1-ethyl-5-methylpyrazol-4-amine
CID 122168522

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine?
The IUPAC name of N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine (CID 122167995) is N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine.
What is the SMILES notation for N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine?
The canonical SMILES for N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine is CCn1ncc(NCc2cc(C3CC3)nn2C(C)C)c1C.
What is the InChIKey of N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine?
The InChIKey is FLEZFBOLLQIIBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-5-20-12(4)16(10-18-20)17-9-14-8-15(13-6-7-13)19-21(14)11(2)3/h8,10-11,13,17H,5-7,9H2,1-4H3.
What are the key properties of N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine?
N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine has a molecular weight of 287.41 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopropyl-1-propan-2-ylpyrazol-5-yl)methyl]-1-ethyl-5-methylpyrazol-4-amine is sourced from PubChem (CID 122167995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).