N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine

C14H29N — CID 160722358

IUPACN-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine
SMILESCC(C)[C@H](C)N(C1CC1)C(C)(C)C(C)C
InChIInChI=1S/C14H29N/c1-10(2)12(5)15(13-8-9-13)14(6,7)11(3)4/h10-13H,8-9H2,1-7H3/t12-/m0/s1
InChIKeyTZHYSWAFVLXHDK-LBPRGKRZSA-N
MW211.39 g/mol
LogP3.93
Rot. Bonds5

About N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine

N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine (PubChem CID 160722358) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine.

Molecular Properties

Compound NameN-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine
PubChem CID160722358
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine
SMILESCC(C)[C@H](C)N(C1CC1)C(C)(C)C(C)C
InChIInChI=1S/C14H29N/c1-10(2)12(5)15(13-8-9-13)14(6,7)11(3)4/h10-13H,8-9H2,1-7H3/t12-/m0/s1
InChIKeyTZHYSWAFVLXHDK-LBPRGKRZSA-N
XLogP3.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclopropyl-N-(2,3-dimethylbutan-2-yl)cyclobutanamine
CID 134573917
N-[(2R)-3-methylbutan-2-yl]-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine
CID 160722354
N,2,3-trimethyl-N-[(2S)-3-methylbutan-2-yl]butan-2-amine
CID 158159432
2-cyclopropyl-N,2-dimethyl-N-(3-methylbutan-2-yl)butan-1-amine
CID 123203597
N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine
CID 63157698
N-methyl-N-(3-methylbutan-2-yl)oxan-4-amine
CID 130651987
N-methyl-N-(3-methylbutan-2-yl)thian-4-amine
CID 131067370
2-(aminomethyl)-5-ethyl-N-methyl-N-(3-methylbutan-2-yl)cyclohexan-1-amine
CID 43569707
3,3-dimethylbutan-2-ylcyclopropane
CID 13275215
1-(2,3-dimethylbutan-2-yl)-1-methylhydrazine
CID 166768392
N-methyl-N-propan-2-ylcyclopropanamine
CID 21024125
2-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 80999541

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine?
The IUPAC name of N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine (CID 160722358) is N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine.
What is the SMILES notation for N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine?
The canonical SMILES for N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine is CC(C)[C@H](C)N(C1CC1)C(C)(C)C(C)C.
What is the InChIKey of N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine?
The InChIKey is TZHYSWAFVLXHDK-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H29N/c1-10(2)12(5)15(13-8-9-13)14(6,7)11(3)4/h10-13H,8-9H2,1-7H3/t12-/m0/s1.
What are the key properties of N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine?
N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine has a molecular weight of 211.39 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutan-2-yl)-N-[(2S)-3-methylbutan-2-yl]cyclopropanamine is sourced from PubChem (CID 160722358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).