(1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine

C19H41NOSi — CID 134905899

IUPAC(1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
SMILESCCN(CC)[C@@]1(C)CC1CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H41NOSi/c1-10-20(11-2)19(9)14-18(19)12-13-21-22(15(3)4,16(5)6)17(7)8/h15-18H,10-14H2,1-9H3/t18?,19-/m0/s1
InChIKeyPYBVLNQKVIZCDQ-GGYWPGCISA-N
MW327.63 g/mol
LogP5.69
Rot. Bonds10

About (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine

(1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine (PubChem CID 134905899) has the molecular formula C19H41NOSi and a molecular weight of 327.63 g/mol. Its IUPAC name is (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name(1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
PubChem CID134905899
Molecular FormulaC19H41NOSi
Molecular Weight327.63 g/mol
Exact Mass327.30
IUPAC Name(1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
SMILESCCN(CC)[C@@]1(C)CC1CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H41NOSi/c1-10-20(11-2)19(9)14-18(19)12-13-21-22(15(3)4,16(5)6)17(7)8/h15-18H,10-14H2,1-9H3/t18?,19-/m0/s1
InChIKeyPYBVLNQKVIZCDQ-GGYWPGCISA-N
XLogP5.69
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.63
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(2R,3S)-4-methyl-4-azaspiro[2.4]heptan-2-yl]ethoxy-tri(propan-2-yl)silane
CID 10519129
2-[(2S,3S)-4-methyl-4-azaspiro[2.5]octan-2-yl]ethoxy-tri(propan-2-yl)silane
CID 10639777
cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 10779525
(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 15315174
(1S)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 15321158
(1S)-N,N-diethyl-1-propyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 15321159
(1S)-1-(7-bromoheptyl)-N,N-diethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 134905893
(1S)-N,N-diethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 134905975
(1S)-N,N-dimethyl-1-propyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 134906166
trans-(1R,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 146018994
cis-(1R,2S)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 146018995
trans-(1R,2R)-1-butyl-N,N-diethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 146018996

Frequently Asked Questions

What is the IUPAC name of (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The IUPAC name of (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine (CID 134905899) is (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine.
What is the SMILES notation for (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The canonical SMILES for (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine is CCN(CC)[C@@]1(C)CC1CCO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The InChIKey is PYBVLNQKVIZCDQ-GGYWPGCISA-N. The full InChI is InChI=1S/C19H41NOSi/c1-10-20(11-2)19(9)14-18(19)12-13-21-22(15(3)4,16(5)6)17(7)8/h15-18H,10-14H2,1-9H3/t18?,19-/m0/s1.
What are the key properties of (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
(1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine has a molecular weight of 327.63 g/mol, XLogP of 5.69, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine is sourced from PubChem (CID 134905899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).