(2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium

C11H23NY-2 — CID 59474981

IUPAC(2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium
SMILES[CH2-][C@H](C(C)C)[C@@H]([CH2-])N(C)C(C)C.[Y]
InChIInChI=1S/C11H23N.Y/c1-8(2)10(5)11(6)12(7)9(3)4;/h8-11H,5-6H2,1-4,7H3;/q-2;/t10-,11-;/m1./s1
InChIKeyLBCRUKILWBTDEP-NDXYWBNTSA-N
MW258.22 g/mol
LogP2.63
Rot. Bonds4

About (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium

(2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium (PubChem CID 59474981) has the molecular formula C11H23NY-2 and a molecular weight of 258.22 g/mol. Its IUPAC name is (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium.

Molecular Properties

Compound Name(2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium
PubChem CID59474981
Molecular FormulaC11H23NY-2
Molecular Weight258.22 g/mol
Exact Mass258.09
IUPAC Name(2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium
SMILES[CH2-][C@H](C(C)C)[C@@H]([CH2-])N(C)C(C)C.[Y]
InChIInChI=1S/C11H23N.Y/c1-8(2)10(5)11(6)12(7)9(3)4;/h8-11H,5-6H2,1-4,7H3;/q-2;/t10-,11-;/m1./s1
InChIKeyLBCRUKILWBTDEP-NDXYWBNTSA-N
XLogP2.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.22
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-(1-methylsulfanylethyl)propan-2-amine
CID 123638292
2-methanidylpropane;decakis(yttrium)
CID 167360236
(2R,3R)-3-methanidyl-4-methyl-N-propan-2-ylpentan-2-amine;yttrium
CID 59474967
2-methanidylpropane;titanium(4+);trichloride
CID 174197579
carbanide;2-methanidylpropane;bis(yttrium)
CID 161365817
4-methyl-3-[methyl(propan-2-yl)amino]pentan-2-one
CID 144581032
3-[methyl(propan-2-yl)amino]butan-2-ol
CID 58823788
3-N-methyl-3-N-propan-2-ylbutane-2,3-diamine
CID 61352164
N,N'-dimethyl-1-methylsulfanyl-N'-propan-2-ylmethanediamine
CID 123520155
(3S)-N,2,4-trimethyl-N-propan-2-ylhexan-3-amine
CID 59252899
dipotassium;2-methanidyl-3-methylbutane
CID 58795752
N,N-dimethylpropan-2-amine;ethane
CID 143195472

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium?
The IUPAC name of (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium (CID 59474981) is (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium.
What is the SMILES notation for (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium?
The canonical SMILES for (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium is [CH2-][C@H](C(C)C)[C@@H]([CH2-])N(C)C(C)C.[Y].
What is the InChIKey of (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium?
The InChIKey is LBCRUKILWBTDEP-NDXYWBNTSA-N. The full InChI is InChI=1S/C11H23N.Y/c1-8(2)10(5)11(6)12(7)9(3)4;/h8-11H,5-6H2,1-4,7H3;/q-2;/t10-,11-;/m1./s1.
What are the key properties of (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium?
(2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium has a molecular weight of 258.22 g/mol, XLogP of 2.63, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-3-methanidyl-N,4-dimethyl-N-propan-2-ylpentan-2-amine;yttrium is sourced from PubChem (CID 59474981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).