N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine

C14H27N3O3Si — CID 173156554

IUPACN-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine
SMILESC=C[Si](C(CCC)=NO)(C(CCC)=NO)C(CCC)=NO
InChIInChI=1S/C14H27N3O3Si/c1-5-9-12(15-18)21(8-4,13(16-19)10-6-2)14(17-20)11-7-3/h8,18-20H,4-7,9-11H2,1-3H3
InChIKeyOBVQBKGDNIGGCV-UHFFFAOYSA-N
MW313.47 g/mol
LogP3.67
Rot. Bonds10

About N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine

N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine (PubChem CID 173156554) has the molecular formula C14H27N3O3Si and a molecular weight of 313.47 g/mol. Its IUPAC name is N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine.

Molecular Properties

Compound NameN-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine
PubChem CID173156554
Molecular FormulaC14H27N3O3Si
Molecular Weight313.47 g/mol
Exact Mass313.18
IUPAC NameN-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine
SMILESC=C[Si](C(CCC)=NO)(C(CCC)=NO)C(CCC)=NO
InChIInChI=1S/C14H27N3O3Si/c1-5-9-12(15-18)21(8-4,13(16-19)10-6-2)14(17-20)11-7-3/h8,18-20H,4-7,9-11H2,1-3H3
InChIKeyOBVQBKGDNIGGCV-UHFFFAOYSA-N
XLogP3.67
TPSA97.77 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.47
LogP ≤ 53.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methane;2-methylpent-1-ene;bis(prop-1-ene)
CID 159090973
(NZ)-N-non-1-en-4-ylidenehydroxylamine
CID 88738841
N-[1-[ethenyl-bis(2-hydroxyiminopropyl)silyl]propan-2-ylidene]hydroxylamine
CID 72970143
CID 172586051
CID 172586051
N-nonadec-1-en-4-ylidenehydroxylamine
CID 174804170
methane;hexakis(2-methylpent-1-ene)
CID 175346690
N,N-dimethylmethanamine;N-pent-1-en-3-ylidenehydroxylamine;silane
CID 174664874
N-pent-1-en-2-ylprop-2-en-1-imine
CID 142986997
(3Z)-hepta-1,3-dien-4-ol
CID 23128228
hepta-1,3-diene-3,4-diol
CID 140987988
sodium;hydride;2-methylpent-1-ene
CID 174251970
4,5-dimethylideneoctane
CID 13294231

Frequently Asked Questions

What is the IUPAC name of N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine?
The IUPAC name of N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine (CID 173156554) is N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine.
What is the SMILES notation for N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine?
The canonical SMILES for N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine is C=C[Si](C(CCC)=NO)(C(CCC)=NO)C(CCC)=NO.
What is the InChIKey of N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine?
The InChIKey is OBVQBKGDNIGGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O3Si/c1-5-9-12(15-18)21(8-4,13(16-19)10-6-2)14(17-20)11-7-3/h8,18-20H,4-7,9-11H2,1-3H3.
What are the key properties of N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine?
N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine has a molecular weight of 313.47 g/mol, XLogP of 3.67, 10 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[ethenyl-bis(N-hydroxy-C-propylcarbonimidoyl)silyl]butylidene]hydroxylamine is sourced from PubChem (CID 173156554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).