N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine

C16H30N4 — CID 114011256

IUPACN-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine
SMILESCC(C)CCN(CCC(C)C)Cc1cc(NN)ccn1
InChIInChI=1S/C16H30N4/c1-13(2)6-9-20(10-7-14(3)4)12-16-11-15(19-17)5-8-18-16/h5,8,11,13-14H,6-7,9-10,12,17H2,1-4H3,(H,18,19)
InChIKeyOFGCMUCFDGSRTD-UHFFFAOYSA-N
MW278.44 g/mol
LogP3.26
Rot. Bonds9

About N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine

N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine (PubChem CID 114011256) has the molecular formula C16H30N4 and a molecular weight of 278.44 g/mol. Its IUPAC name is N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine.

Molecular Properties

Compound NameN-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine
PubChem CID114011256
Molecular FormulaC16H30N4
Molecular Weight278.44 g/mol
Exact Mass278.25
IUPAC NameN-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine
SMILESCC(C)CCN(CCC(C)C)Cc1cc(NN)ccn1
InChIInChI=1S/C16H30N4/c1-13(2)6-9-20(10-7-14(3)4)12-16-11-15(19-17)5-8-18-16/h5,8,11,13-14H,6-7,9-10,12,17H2,1-4H3,(H,18,19)
InChIKeyOFGCMUCFDGSRTD-UHFFFAOYSA-N
XLogP3.26
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine with MolForge

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Related Compounds

N'-[(4-hydrazinyl-2-pyridinyl)methyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 79259446
N-butyl-N-[(4-hydrazinyl-2-pyridinyl)methyl]butan-1-amine
CID 79259739
N-ethyl-N-[(4-hydrazinyl-2-pyridinyl)methyl]propan-1-amine
CID 79260106
N'-[(4-hydrazinyl-2-pyridinyl)methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 79259826
N-benzyl-N-[(4-hydrazinyl-2-pyridinyl)methyl]-1-phenylmethanamine
CID 130161547
N-ethyl-2,2,2-trifluoro-N-[(4-hydrazinyl-2-pyridinyl)methyl]ethanamine
CID 79259080
2-[ethyl-[(4-hydrazinyl-2-pyridinyl)methyl]amino]-N-methylacetamide
CID 79259822
N-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methyl-1-thiophen-2-ylethanamine
CID 79259173
N,N-dimethyl-N'-(2-methylpropyl)-N'-[[4-(propylamino)-2-pyridinyl]methyl]ethane-1,2-diamine
CID 79245192
N-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methyl-1-pyridin-4-ylmethanamine
CID 79259077
2-[[4-(ethylamino)-2-pyridinyl]methyl-(2-methylpropyl)amino]acetamide
CID 79245129
1-(4-hydrazinyl-2-pyridinyl)-N-methyl-N-(1,3-thiazol-4-ylmethyl)methanamine
CID 79259170

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine?
The IUPAC name of N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine (CID 114011256) is N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine.
What is the SMILES notation for N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine?
The canonical SMILES for N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine is CC(C)CCN(CCC(C)C)Cc1cc(NN)ccn1.
What is the InChIKey of N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine?
The InChIKey is OFGCMUCFDGSRTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4/c1-13(2)6-9-20(10-7-14(3)4)12-16-11-15(19-17)5-8-18-16/h5,8,11,13-14H,6-7,9-10,12,17H2,1-4H3,(H,18,19).
What are the key properties of N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine?
N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine has a molecular weight of 278.44 g/mol, XLogP of 3.26, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydrazinyl-2-pyridinyl)methyl]-3-methyl-N-(3-methylbutyl)butan-1-amine is sourced from PubChem (CID 114011256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).