3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine

C14H24N2 — CID 81022881

IUPAC3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine
SMILESCc1ccncc1C(C)(C)CCNC(C)C
InChIInChI=1S/C14H24N2/c1-11(2)16-9-7-14(4,5)13-10-15-8-6-12(13)3/h6,8,10-11,16H,7,9H2,1-5H3
InChIKeyZYDTVFLBBOUBEU-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.06
Rot. Bonds5

About 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine

3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine (PubChem CID 81022881) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine.

Molecular Properties

Compound Name3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine
PubChem CID81022881
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine
SMILESCc1ccncc1C(C)(C)CCNC(C)C
InChIInChI=1S/C14H24N2/c1-11(2)16-9-7-14(4,5)13-10-15-8-6-12(13)3/h6,8,10-11,16H,7,9H2,1-5H3
InChIKeyZYDTVFLBBOUBEU-UHFFFAOYSA-N
XLogP3.06
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-propan-2-yl-3-[2-(trifluoromethyl)phenyl]butan-1-amine
CID 81022627
3-methyl-3-naphthalen-1-yl-N-propan-2-ylbutan-1-amine
CID 79830054
3-(4-fluoro-3-methylphenyl)-3-methyl-N-propan-2-ylbutan-1-amine
CID 79830965
3,3-dimethyl-N-propan-2-yl-4-pyridin-3-ylbutan-1-amine
CID 104737370
3-(2,5-dichlorophenyl)-3-methyl-N-propan-2-ylbutan-1-amine
CID 79830945
3-(2,3-dichlorophenyl)-3-methyl-N-propan-2-ylbutan-1-amine
CID 81021922
3-(5-fluoro-3-pyridinyl)-3-methyl-N-propan-2-ylbutan-1-amine
CID 81022234
N-(2-methyl-2-pyridin-3-ylpropyl)-N'-propan-2-ylethane-1,2-diamine
CID 115206679
N'-propan-2-yl-N-pyridin-4-ylethane-1,2-diamine
CID 62662678
N-[(3-methyl-4-pyridinyl)methyl]-2-(propan-2-ylamino)ethanesulfonamide
CID 114701089
2-(4-methyl-3-pyridinyl)butan-2-ol
CID 66273296
2-methyl-N-propan-2-yl-2-pyridin-4-ylpropan-1-amine
CID 80525312

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine?
The IUPAC name of 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine (CID 81022881) is 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine.
What is the SMILES notation for 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine?
The canonical SMILES for 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine is Cc1ccncc1C(C)(C)CCNC(C)C.
What is the InChIKey of 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine?
The InChIKey is ZYDTVFLBBOUBEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-11(2)16-9-7-14(4,5)13-10-15-8-6-12(13)3/h6,8,10-11,16H,7,9H2,1-5H3.
What are the key properties of 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine?
3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine has a molecular weight of 220.36 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(4-methyl-3-pyridinyl)-N-propan-2-ylbutan-1-amine is sourced from PubChem (CID 81022881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).