6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine

C14H25N3 — CID 103937401

IUPAC6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(C)C(C)(C)CC)cn1
InChIInChI=1S/C14H25N3/c1-6-12(15)13-9-8-11(10-16-13)17(5)14(3,4)7-2/h8-10,12H,6-7,15H2,1-5H3/t12-/m0/s1
InChIKeyIUNQOTFSPBVHHN-LBPRGKRZSA-N
MW235.38 g/mol
LogP3.12
Rot. Bonds5

About 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine

6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine (PubChem CID 103937401) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine
PubChem CID103937401
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(C)C(C)(C)CC)cn1
InChIInChI=1S/C14H25N3/c1-6-12(15)13-9-8-11(10-16-13)17(5)14(3,4)7-2/h8-10,12H,6-7,15H2,1-5H3/t12-/m0/s1
InChIKeyIUNQOTFSPBVHHN-LBPRGKRZSA-N
XLogP3.12
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(1-aminoethyl)-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine
CID 83128029
6-(1-aminopropyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-3-amine
CID 112584377
6-(1-aminopropyl)-N,N-diethylpyridin-3-amine
CID 112584036
6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine
CID 103936975
6-(1-aminopropyl)-N,N-bis(2-methylpropyl)pyridin-3-amine
CID 112584255
2-N-[6-[(1R)-1-aminopropyl]-3-pyridinyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103189419
6-(1-aminopropyl)-N-ethyl-N-phenylpyridin-3-amine
CID 112584084
6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine
CID 103936956
6-[(1R)-1-aminopropyl]-N-(cyclopropylmethyl)-N-methylpyridin-3-amine
CID 103937043
6-[(1R)-1-aminopropyl]-N-methyl-N-(4-methylcyclohexyl)pyridin-3-amine
CID 103937109
6-(1-aminopropyl)-N-ethyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
CID 112584364
6-[(1S)-1-aminopropyl]-N-methyl-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine
CID 103937223

Frequently Asked Questions

What is the IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine?
The IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine (CID 103937401) is 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine.
What is the SMILES notation for 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine?
The canonical SMILES for 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine is CC[C@H](N)c1ccc(N(C)C(C)(C)CC)cn1.
What is the InChIKey of 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine?
The InChIKey is IUNQOTFSPBVHHN-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H25N3/c1-6-12(15)13-9-8-11(10-16-13)17(5)14(3,4)7-2/h8-10,12H,6-7,15H2,1-5H3/t12-/m0/s1.
What are the key properties of 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine?
6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine has a molecular weight of 235.38 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine is sourced from PubChem (CID 103937401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).