N-methyltridecan-1-amine;molecular hydrogen

C14H33N — CID 153363446

IUPACN-methyltridecan-1-amine;molecular hydrogen
SMILESCCCCCCCCCCCCCNC.[H][H]
InChIInChI=1S/C14H31N.H2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-2;/h15H,3-14H2,1-2H3;1H
InChIKeyVTBJWQCSPGHEBS-UHFFFAOYSA-N
MW215.42 g/mol
LogP4.76
Rot. Bonds12

About N-methyltridecan-1-amine;molecular hydrogen

N-methyltridecan-1-amine;molecular hydrogen (PubChem CID 153363446) has the molecular formula C14H33N and a molecular weight of 215.42 g/mol. Its IUPAC name is N-methyltridecan-1-amine;molecular hydrogen.

Molecular Properties

Compound NameN-methyltridecan-1-amine;molecular hydrogen
PubChem CID153363446
Molecular FormulaC14H33N
Molecular Weight215.42 g/mol
Exact Mass215.26
IUPAC NameN-methyltridecan-1-amine;molecular hydrogen
SMILESCCCCCCCCCCCCCNC.[H][H]
InChIInChI=1S/C14H31N.H2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-2;/h15H,3-14H2,1-2H3;1H
InChIKeyVTBJWQCSPGHEBS-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.42
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-methylheptan-1-amine;molecular hydrogen;propane
CID 144955567
N-methyltriacontan-1-amine
CID 19840895
hydroxylamine;N-methyloctan-1-amine
CID 144676839
N,N'-dimethylheptane-1,7-diamine;ethane;molecular hydrogen
CID 176578398
N'-dodecyl-N-methylpropane-1,3-diamine
CID 19812622
N'-hexadecyl-N-methylpropane-1,3-diamine
CID 46736042
N-methyloctan-1-amine;propan-1-ol
CID 88540071
1-chloropentane;N-methyloctan-1-amine
CID 174674151
N-methylbutan-1-amine
CID 8068
tris(N-methyldodecan-1-amine);phosphoric acid
CID 175134049
dihydroxy(oxo)phosphanium;N-methyloctadecan-1-amine
CID 19904990
4-(6-hexoxyhexoxy)-N-methylbutan-1-amine
CID 164959438

Frequently Asked Questions

What is the IUPAC name of N-methyltridecan-1-amine;molecular hydrogen?
The IUPAC name of N-methyltridecan-1-amine;molecular hydrogen (CID 153363446) is N-methyltridecan-1-amine;molecular hydrogen.
What is the SMILES notation for N-methyltridecan-1-amine;molecular hydrogen?
The canonical SMILES for N-methyltridecan-1-amine;molecular hydrogen is CCCCCCCCCCCCCNC.[H][H].
What is the InChIKey of N-methyltridecan-1-amine;molecular hydrogen?
The InChIKey is VTBJWQCSPGHEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N.H2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-2;/h15H,3-14H2,1-2H3;1H.
What are the key properties of N-methyltridecan-1-amine;molecular hydrogen?
N-methyltridecan-1-amine;molecular hydrogen has a molecular weight of 215.42 g/mol, XLogP of 4.76, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyltridecan-1-amine;molecular hydrogen is sourced from PubChem (CID 153363446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).