N,N'-dipyridin-4-ylheptane-1,7-diamine

C17H24N4 — CID 23645208

IUPACN,N'-dipyridin-4-ylheptane-1,7-diamine
SMILESc1cc(NCCCCCCCNc2ccncc2)ccn1
InChIInChI=1S/C17H24N4/c1(2-4-10-20-16-6-12-18-13-7-16)3-5-11-21-17-8-14-19-15-9-17/h6-9,12-15H,1-5,10-11H2,(H,18,20)(H,19,21)
InChIKeyDPHBVJUIPAIHRQ-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.95
Rot. Bonds10

About N,N'-dipyridin-4-ylheptane-1,7-diamine

N,N'-dipyridin-4-ylheptane-1,7-diamine (PubChem CID 23645208) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N,N'-dipyridin-4-ylheptane-1,7-diamine.

Molecular Properties

Compound NameN,N'-dipyridin-4-ylheptane-1,7-diamine
PubChem CID23645208
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN,N'-dipyridin-4-ylheptane-1,7-diamine
SMILESc1cc(NCCCCCCCNc2ccncc2)ccn1
InChIInChI=1S/C17H24N4/c1(2-4-10-20-16-6-12-18-13-7-16)3-5-11-21-17-8-14-19-15-9-17/h6-9,12-15H,1-5,10-11H2,(H,18,20)(H,19,21)
InChIKeyDPHBVJUIPAIHRQ-UHFFFAOYSA-N
XLogP3.95
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-chlorobutyl)pyridin-4-amine
CID 106845129
N-(15,15-dimethylhexadecyl)pyridin-4-amine
CID 173437597
3-(pyridin-4-ylamino)propyl hypoiodite
CID 143003434
N-(6-piperidin-1-ylhexyl)pyridin-4-amine;dihydrochloride
CID 11151770
4-methyl-1-N-pyridin-4-ylpentane-1,4-diamine
CID 115205190
1-N-pyridin-4-ylpentane-1,4-diamine
CID 106127738
N-(3-pyrazol-1-ylpropyl)pyridin-4-amine
CID 115669379
N-cyclopentyl-N'-pyridin-4-ylpropane-1,3-diamine
CID 115689729
N-(iodomethyl)pyridin-4-amine
CID 153167423
N-propyl-N'-pyridin-4-ylethane-1,2-diamine
CID 62664105
N'-propan-2-yl-N-pyridin-4-ylethane-1,2-diamine
CID 62662678
4-(pyridin-4-ylamino)butan-2-one
CID 89125446

Frequently Asked Questions

What is the IUPAC name of N,N'-dipyridin-4-ylheptane-1,7-diamine?
The IUPAC name of N,N'-dipyridin-4-ylheptane-1,7-diamine (CID 23645208) is N,N'-dipyridin-4-ylheptane-1,7-diamine.
What is the SMILES notation for N,N'-dipyridin-4-ylheptane-1,7-diamine?
The canonical SMILES for N,N'-dipyridin-4-ylheptane-1,7-diamine is c1cc(NCCCCCCCNc2ccncc2)ccn1.
What is the InChIKey of N,N'-dipyridin-4-ylheptane-1,7-diamine?
The InChIKey is DPHBVJUIPAIHRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1(2-4-10-20-16-6-12-18-13-7-16)3-5-11-21-17-8-14-19-15-9-17/h6-9,12-15H,1-5,10-11H2,(H,18,20)(H,19,21).
What are the key properties of N,N'-dipyridin-4-ylheptane-1,7-diamine?
N,N'-dipyridin-4-ylheptane-1,7-diamine has a molecular weight of 284.41 g/mol, XLogP of 3.95, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dipyridin-4-ylheptane-1,7-diamine is sourced from PubChem (CID 23645208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).