CID 177405056

C14H28N2 — CID 177405056

IUPAC—
SMILESCCCCN1[C]N(C(C)(C)C)[C@@H](C(C)C)C1
InChIInChI=1S/C14H28N2/c1-7-8-9-15-10-13(12(2)3)16(11-15)14(4,5)6/h12-13H,7-10H2,1-6H3/t13-/m1/s1
InChIKeyUDAMPQRXMYBVMU-CYBMUJFWSA-N
MW224.39 g/mol
LogP3.22
Rot. Bonds4

About CID 177405056

CID 177405056 (PubChem CID 177405056) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol.

Molecular Properties

Compound NameCID 177405056
PubChem CID177405056
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name—
SMILESCCCCN1[C]N(C(C)(C)C)[C@@H](C(C)C)C1
InChIInChI=1S/C14H28N2/c1-7-8-9-15-10-13(12(2)3)16(11-15)14(4,5)6/h12-13H,7-10H2,1-6H3/t13-/m1/s1
InChIKeyUDAMPQRXMYBVMU-CYBMUJFWSA-N
XLogP3.22
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-butyl-2-propan-2-ylaziridine
CID 175612438
4-tert-butyl-1-ethyl-2-propan-2-ylpiperazine
CID 70790415
1-butyl-4-(3-methylbutyl)piperidine
CID 167107380
(2R)-1-methyl-2-propan-2-ylaziridine
CID 140882357
2-butyl-3-propan-2-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79926630
1-(2-butoxyethyl)-5-tert-butyl-2-propan-2-ylpiperazine
CID 64842412
1-tert-butyl-4-[2-(1-butylazetidin-3-yl)ethyl]piperazine
CID 155215089
3-tert-butyl-1-heptylazetidine
CID 157310046
4-butyl-1,2,6-trimethylpiperazine
CID 126991132
1-methyl-4-propan-2-ylpiperidine;pentane
CID 163403210
ethane;5-ethyl-1-methyl-2-propan-2-ylpiperidine
CID 170771702
5-methyl-1-octan-2-yl-2-propan-2-ylpiperazine
CID 64936589

Frequently Asked Questions

What is the IUPAC name of CID 177405056?
The IUPAC name of CID 177405056 (CID 177405056) is not available.
What is the SMILES notation for CID 177405056?
The canonical SMILES for CID 177405056 is CCCCN1[C]N(C(C)(C)C)[C@@H](C(C)C)C1.
What is the InChIKey of CID 177405056?
The InChIKey is UDAMPQRXMYBVMU-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H28N2/c1-7-8-9-15-10-13(12(2)3)16(11-15)14(4,5)6/h12-13H,7-10H2,1-6H3/t13-/m1/s1.
What are the key properties of CID 177405056?
CID 177405056 has a molecular weight of 224.39 g/mol, XLogP of 3.22, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177405056 is sourced from PubChem (CID 177405056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).