N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine

C14H21F3N2 — CID 63539653

IUPACN-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)CCCC(C)Nc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H21F3N2/c1-10(2)5-4-6-11(3)19-13-8-7-12(9-18-13)14(15,16)17/h7-11H,4-6H2,1-3H3,(H,18,19)
InChIKeyUDTCMGQSEAQDNX-UHFFFAOYSA-N
MW274.33 g/mol
LogP4.73
Rot. Bonds6

About N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine

N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 63539653) has the molecular formula C14H21F3N2 and a molecular weight of 274.33 g/mol. Its IUPAC name is N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID63539653
Molecular FormulaC14H21F3N2
Molecular Weight274.33 g/mol
Exact Mass274.17
IUPAC NameN-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)CCCC(C)Nc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H21F3N2/c1-10(2)5-4-6-11(3)19-13-8-7-12(9-18-13)14(15,16)17/h7-11H,4-6H2,1-3H3,(H,18,19)
InChIKeyUDTCMGQSEAQDNX-UHFFFAOYSA-N
XLogP4.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-N-(5-chloropentan-2-yl)pyridin-2-amine
CID 107875581
N-(3-methylbutan-2-yl)-5-(trifluoromethyl)pyridin-2-amine
CID 43084333
1-N,1-N,3-trimethyl-2-N-[5-(trifluoromethyl)-2-pyridinyl]butane-1,2-diamine
CID 61479974
N-but-3-en-2-yl-5-(trifluoromethyl)pyridin-2-amine
CID 115691993
N-(6-methylheptan-2-yl)pyridin-2-amine
CID 61472531
N-(1-chloro-4,4-dimethylpentan-3-yl)-5-(trifluoromethyl)pyridin-2-amine
CID 106354398
N,N-dimethyl-6-(6-methylheptan-2-ylamino)pyridine-3-sulfonamide
CID 103340977
3-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanyl-2-[[5-(trifluoromethyl)-2-pyridinyl]amino]propanoic acid
CID 58167557
N-[1-(furan-2-yl)ethyl]-5-(trifluoromethyl)pyridin-2-amine
CID 43399613
ethyl 2-[[5-(trifluoromethyl)-2-pyridinyl]amino]propanoate
CID 61498811
6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine
CID 61472487
5-chloro-N-(5-methylhexan-2-yl)pyridin-2-amine
CID 63925701

Frequently Asked Questions

What is the IUPAC name of N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine (CID 63539653) is N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine is CC(C)CCCC(C)Nc1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is UDTCMGQSEAQDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21F3N2/c1-10(2)5-4-6-11(3)19-13-8-7-12(9-18-13)14(15,16)17/h7-11H,4-6H2,1-3H3,(H,18,19).
What are the key properties of N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine?
N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 274.33 g/mol, XLogP of 4.73, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 63539653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).