1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine

C15H29N5 — CID 105243226

IUPAC1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine
SMILESCCCn1cc(C(NN)C2(N(C)C)CCCCC2)cn1
InChIInChI=1S/C15H29N5/c1-4-10-20-12-13(11-17-20)14(18-16)15(19(2)3)8-6-5-7-9-15/h11-12,14,18H,4-10,16H2,1-3H3
InChIKeyMPUVHYNIXZELFE-UHFFFAOYSA-N
MW279.43 g/mol
LogP2.06
Rot. Bonds6

About 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine

1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine (PubChem CID 105243226) has the molecular formula C15H29N5 and a molecular weight of 279.43 g/mol. Its IUPAC name is 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine
PubChem CID105243226
Molecular FormulaC15H29N5
Molecular Weight279.43 g/mol
Exact Mass279.24
IUPAC Name1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine
SMILESCCCn1cc(C(NN)C2(N(C)C)CCCCC2)cn1
InChIInChI=1S/C15H29N5/c1-4-10-20-12-13(11-17-20)14(18-16)15(19(2)3)8-6-5-7-9-15/h11-12,14,18H,4-10,16H2,1-3H3
InChIKeyMPUVHYNIXZELFE-UHFFFAOYSA-N
XLogP2.06
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-1-[methylamino-(1-propylpyrazol-4-yl)methyl]cycloheptan-1-amine
CID 79064560
[(1-methoxycyclohexyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105275993
[(1-ethylcyclopentyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105288552
[(1-methoxycyclopentyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105268662
1-[(1-ethylpyrazol-4-yl)-(propylamino)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79061750
[(1-phenylcyclobutyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105217295
1-[(4-chloro-1-propylpyrazol-5-yl)-hydrazinylmethyl]-N,N-dimethylcyclohexan-1-amine
CID 105243209
[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105278414
[(1-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105288735
[(1-ethylpyrazol-4-yl)-(2-methyloxan-2-yl)methyl]hydrazine
CID 105256090
N,N-dimethyl-1-[methylamino-(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine
CID 79069835
N-[(1-ethoxycyclopentyl)-(1-propylpyrazol-4-yl)methyl]ethanamine
CID 116762281

Frequently Asked Questions

What is the IUPAC name of 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine?
The IUPAC name of 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine (CID 105243226) is 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine?
The canonical SMILES for 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine is CCCn1cc(C(NN)C2(N(C)C)CCCCC2)cn1.
What is the InChIKey of 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine?
The InChIKey is MPUVHYNIXZELFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5/c1-4-10-20-12-13(11-17-20)14(18-16)15(19(2)3)8-6-5-7-9-15/h11-12,14,18H,4-10,16H2,1-3H3.
What are the key properties of 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine?
1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine has a molecular weight of 279.43 g/mol, XLogP of 2.06, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[hydrazinyl-(1-propylpyrazol-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine is sourced from PubChem (CID 105243226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).