(3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine

C14H29N3 — CID 143986808

IUPAC(3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine
SMILESC=C(NC(C)C(C)C)[C@H](C)CCC1CNCN1
InChIInChI=1S/C14H29N3/c1-10(2)12(4)17-13(5)11(3)6-7-14-8-15-9-16-14/h10-12,14-17H,5-9H2,1-4H3/t11-,12?,14?/m1/s1
InChIKeyQFKPIRZIIMIMEH-LKSINWNRSA-N
MW239.41 g/mol
LogP2.07
Rot. Bonds7

About (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine

(3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine (PubChem CID 143986808) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine.

Molecular Properties

Compound Name(3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine
PubChem CID143986808
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name(3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine
SMILESC=C(NC(C)C(C)C)[C@H](C)CCC1CNCN1
InChIInChI=1S/C14H29N3/c1-10(2)12(4)17-13(5)11(3)6-7-14-8-15-9-16-14/h10-12,14-17H,5-9H2,1-4H3/t11-,12?,14?/m1/s1
InChIKeyQFKPIRZIIMIMEH-LKSINWNRSA-N
XLogP2.07
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-[(2S,4R)-4-propan-2-ylpyrrolidin-2-yl]ethenamine
CID 89432904
N,N-dimethyl-1-[(4R)-4-propan-2-ylpyrrolidin-2-yl]ethenamine
CID 122625758
4-(3,5-Dimethylimidazolidin-4-yl)-1,2,3,4-tetrahydropyridin-5-amine
CID 129134684
3-Ethyl-5-methylidene-2-propan-2-ylpyrrolidine
CID 132264002
4-Methylidene-2-pentylidene-5-propan-2-ylimidazolidine
CID 137433423
1-(4-Tert-butylpyrrolidin-2-yl)ethenamine
CID 138531774
Ethane;1-(2-methylidenepyrrolidin-3-yl)propan-2-amine
CID 141970635
2-(2,3-dihydro-1H-imidazol-4-yl)hexan-1-amine
CID 142002737
3-methyl-N-[1-(1-propylpyrrolidin-2-yl)ethenyl]butan-2-amine
CID 142079243
(2R)-2,4-dimethyl-1-N-[1-[(2S,3S)-3-methylpyrrolidin-2-yl]ethenyl]hex-5-ene-1,5-diamine
CID 142986526
2-[2-(1-aminoethenyl)pyrrolidin-1-yl]-6-methyl-N-prop-1-en-2-ylhept-1-en-4-amine;ethane;propane
CID 143643581
N-ethyl-1-(4-methylpyrrolidin-2-yl)ethenamine
CID 144691864

Frequently Asked Questions

What is the IUPAC name of (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine?
The IUPAC name of (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine (CID 143986808) is (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine.
What is the SMILES notation for (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine?
The canonical SMILES for (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine is C=C(NC(C)C(C)C)[C@H](C)CCC1CNCN1.
What is the InChIKey of (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine?
The InChIKey is QFKPIRZIIMIMEH-LKSINWNRSA-N. The full InChI is InChI=1S/C14H29N3/c1-10(2)12(4)17-13(5)11(3)6-7-14-8-15-9-16-14/h10-12,14-17H,5-9H2,1-4H3/t11-,12?,14?/m1/s1.
What are the key properties of (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine?
(3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine has a molecular weight of 239.41 g/mol, XLogP of 2.07, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-imidazolidin-4-yl-3-methyl-N-(3-methylbutan-2-yl)pent-1-en-2-amine is sourced from PubChem (CID 143986808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).